{"id":3769,"date":"2025-01-16T10:30:08","date_gmt":"2025-01-16T09:30:08","guid":{"rendered":"http:\/\/10.128.3.28\/?page_id=3769"},"modified":"2025-01-23T10:39:00","modified_gmt":"2025-01-23T09:39:00","slug":"ciencias-de-la-vida","status":"publish","type":"page","link":"https:\/\/computaex.es\/en\/ciencias-de-la-vida\/","title":{"rendered":"Ciencias de la Vida"},"content":{"rendered":"\t\t<div data-elementor-type=\"wp-page\" data-elementor-id=\"3769\" class=\"elementor elementor-3769\">\n\t\t\t\t<div class=\"elementor-element elementor-element-7fcb8ab e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"7fcb8ab\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-5f8c668 elementor-widget elementor-widget-text-editor\" data-id=\"5f8c668\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyectos\/proyecto-corrosion-inhibition-from-first-principles-the-role-of-the-oxide\/\">Corrosion inhibition from first principles: the role of the oxide<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Investigador principal:\u00a0Pablo Ordej\u00f3n.<\/li><li>Investigadores:\u00a0Alberto Garc\u00eda Arribas,\u00a0Jos\u00e9 Mar\u00ed\u00ada Castillo Robles,\u00a0Pol Febrer,\u00a0Roberta Farris,\u00a0Jos\u00e9 Mar\u00eda Escart\u00edn,\u00a0Vladimir Dikan,\u00a0Irina Lebedeva,\u00a0Federico Pedr\u00f3n,\u00a0Catalina Coll.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Corrosion is a critical technological problem, and finding green alternatives to the toxic inorganic compounds used to prevent it is a very hot research topic. The use of small organic molecules as inhibitors has increased significantly in recent years due to their low toxicity. Nevertheless, the mechanisms underlying corrosion inhibition (CI) by these molecules are still unknown.<br \/>Molecular modelling was widely applied to find structure-activity relationships for several inhibitors. However, the CI process is a complex problem that requires more refined simulations to be properly understood.<br \/>Here we propose using a state-of-the-art methodology combining DFT, NEGF, and QM\/MM to tackle that problem, allowing us to reach long MD simulations fully accounting for the potential applied to the electrodes and the solvent effects.<\/p><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyectos\/proyecto-corrosion-inhibition-from-first-principles-the-role-of-the-oxide\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-529db99 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"529db99\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-a492363 elementor-widget elementor-widget-text-editor\" data-id=\"a492363\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-optimization-of-composition-and-interfacial-properties-of-halide-solid-electrolytes\/\">Optimization of composition and interfacial properties of halide solid electrolytes<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Investigador principal:\u00a0Javier Carrasco Rodr\u00edguez.<\/li><li>Investigador:\u00a0Andrey Golov.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>One of the main challenges in the development of all-solid-state batteries is the search for suitable solid electrolytes (SEs) that simultaneously exhibit high ionic conductivity, chemical stability, and compatibility with the electrode materials. The Li2ZrCl6 (LZC) SE is a promising candidate due to its high lithium-ion conductivity and excellent (electro)chemical stability.<br \/>Nevertheless, the practical application of LZC requires improvement of the bulk and interfacial ionic conductivity of the SE. For this purpose, we will calculate reactivity and ionic conductivity using ab initio molecular dynamics simulations of interface models.<br \/>Based on the result of these simulations we will propose strategies for the optimization of bulk and interfacial properties of the LZC SE by tuning the electrolyte composition.<\/p><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-optimization-of-composition-and-interfacial-properties-of-halide-solid-electrolytes\/\" data-wplink-edit=\"true\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-e7b992b e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"e7b992b\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-a5d003c elementor-widget elementor-widget-text-editor\" data-id=\"a5d003c\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-harnessing-thermoelectric-potential-of-fe-ni-skutterudites-a-combined-experimental-and-theoretical-approach\/\">Harnessing Thermoelectric Potential of Fe-Ni Skutterudites: A Combined Experimental and Theoretical Approach<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Investigador Principal:\u00a0\u00a0Jos\u00e9 Javier Plata Ramos.<\/li><li>Investigadores:\u00a0Antonio M. M\u00e1rquez Cruz,\u00a0Javier Fern\u00e1ndez Sanz,\u00a0Julia Santana Andreo,\u00a0Javier Amaya Su\u00e1rez,\u00a0Ernesto Blancas Jim\u00e9nez,\u00a0Pinku Nath,\u00a0Elena Rodr\u00edquez Remesal.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>In our society, more than 66% of generated energy is wasted, most of it as heat. Thermoelectric, TE, devices stand as the most promising technology to recover part of this wasted heat. Traditionally, TE material efficiency is measured by the figure of merit, zT. Reducing lattice thermal conductivity, kl, is probably the most straightforward approach to enhance zT.<br \/>While most of these models are designed to predict directly one of the quantities that are related to zT, the biggest challenge is to establish connections between real space (atomic structure, chemical composition and microstructure) and reciprocal space properties (transport properties and zT).<br \/>Our goal is to connect the variables that can be controlled during the design, synthesis and processing of a TE material with their final transport properties and efficiency.<\/p><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-harnessing-thermoelectric-potential-of-fe-ni-skutterudites-a-combined-experimental-and-theoretical-approach\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-bc05e95 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"bc05e95\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-2668e28 elementor-widget elementor-widget-text-editor\" data-id=\"2668e28\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyectos-precise-characterization-of-the-low-temperature-structures-of-vanadium-oxides\/\">Precise characterization of the low temperature structures of vanadium oxides<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Investigador Principal:\u00a0Jos\u00e9 \u00c1ngel Silva Guillen<\/li><li>Investigadores:\u00a0V\u00edctor Manuel Garc\u00eda Su\u00e1rez. Pablo Alonso Gonz\u00e1lez. Javier Mart\u00edn S\u00e1nchez.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Vanadium pentaoxide is a van der Waals material that recently has been found extremely promising for manipulating light at the nanoscale. Since it exhibits phonon-polaritons, it has brought a lot of excitement to the nano-optics community. In addition the properties can be tuned through cation intercalation.<br \/>In the proposed Activity we will study the structure, phonon dispersions, electronic, optical and magnetic properties of V2O5 and NaV2O5 in bulk and flakes at different temperatures in order to understand key aspects to control the optical emission properties in van der Waals materials.<br \/>The work will be carried out in close collaboration with experimental partners.<\/p><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyectos-precise-characterization-of-the-low-temperature-structures-of-vanadium-oxides\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-88882a2 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"88882a2\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-fff6db7 elementor-widget elementor-widget-text-editor\" data-id=\"fff6db7\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyectos\/proyecto-3d-solar-magneto-convection-simulations-extended-to-the-corona-with-the-mancha3d-code\/\">3D solar magneto-convection simulations extended to the corona with the MANCHA3D code<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Ana Mar\u00eda Navarro Noguera<\/p><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la Red Espa\u00f1ola de Supercomputaci\u00f3n (RES)<\/p><p>The aim of our research project is to investigate via numerical modeling one of the fundamental unsolved problems in solar physics &#8211; the heating mechanisms of the solar chromosphere. It will be done by a thorough examination of the most important non-ideal effects derived by the low ionization degree of the plasma using the single and two-fluid (plasma-neutral) frameworks.<br \/>As an intermediate step, here we perform 3D realistic magneto-convection models extended to the corona in the one-fluid approximation. For the first time, we will examine the chromospheric heating due to joint action of the thermal conduction and ambipolar diffusion in a large span of magnetic field topologies and field strengths in a self-consistent coupled model from the upper convection zone to the solar corona.<\/p><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyectos\/proyecto-3d-solar-magneto-convection-simulations-extended-to-the-corona-with-the-mancha3d-code\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-7e27af1 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"7e27af1\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-ce8efdb elementor-widget elementor-widget-text-editor\" data-id=\"ce8efdb\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-computational-modelling-of-the-lattice-thermal-conductivity-of-skutterudites-under-pressure\/\">Computational modelling of the lattice thermal conductivity of skutterudites under pressure<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Jos\u00e9 Javier Plata Ramos. Universidad de Sevilla (<a href=\"https:\/\/www.us.es\/\" target=\"_blank\" rel=\"noopener\">US<\/a>).<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la Red Espa\u00f1ola de Supercomputaci\u00f3n (<a href=\"https:\/\/www.res.es\/\" target=\"_blank\" rel=\"noopener\">RES<\/a>).<\/p><p>In our society, more than 66% of generated energy is wasted, most of it as heat. Thermoelectric, TE, devices stand as the most promising technology to recover part of this wasted heat. Traditionally, TE material efficiency is measured by the figure of merit, zT. Reducing lattice thermal conductivity, kl, is probably the most straightforward approach to enhance zT. While most of these models are designed to predict directly one of the quantities that are related to zT, the biggest challenge is to establish connections between real space (atomic structure, chemical composition and microstructure) and reciprocal space properties (transport properties and zT). Our goal is to connect the variables that can be controlled during the design, synthesis and processing of a TE material with their final transport properties and efficiency.<\/p><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-computational-modelling-of-the-lattice-thermal-conductivity-of-skutterudites-under-pressure\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-64e0b1b e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"64e0b1b\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-e8e4037 elementor-widget elementor-widget-text-editor\" data-id=\"e8e4037\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-segregation-assessment-in-the-manufacturing-process-of-metal-powder-cored-wire\/\">Segregation assessment in the manufacturing process of metal powder cored-wire<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Elena Beatriz Mart\u00edn Ortega.\u00a0<a href=\"https:\/\/www.uvigo.gal\/\" target=\"_blank\" rel=\"noopener\">Universidad de VIGO<\/a>\u00a0&#8211;\u00a0<a href=\"https:\/\/citmaga.gal\/es\/\" target=\"_blank\" rel=\"noopener\">CITMAga<\/a>.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la Red Espa\u00f1ola de Supercomputaci\u00f3n (<a href=\"https:\/\/www.res.es\/\" target=\"_blank\" rel=\"noopener\">RES<\/a>).<\/p><p>Cored wires, used as addition material in different steel and foundry industries, must contain specific concentrations of different metal powders with very different densities and particle sizes. Therefore, undesirable segregation occurs during the wire filling process, especially at the beginning of the production, making the first portion of the final manufactured cored wire unsuitable due to its high inhomogeneity.<br \/>This project proposes to use HPC numerical simulation to predict the segregation during the initial production stage of the cored wire using Discrete Element Models. First, the granular flow in simplified configurations will be studied numerically and experimentally to calibrate the material parameters involved in the model. Then, the simulation of the industrial initial filling process will be carried out and validated.<\/p><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-segregation-assessment-in-the-manufacturing-process-of-metal-powder-cored-wire\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-c7a1678 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"c7a1678\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-d06282b elementor-widget elementor-widget-text-editor\" data-id=\"d06282b\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-plan-complementario-de-biotecnologia-aplicada-a-la-salud\/\">Plan complementario de Biotecnolog\u00eda aplicada a la salud<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Entidades beneficiarias por regiones: Catalu\u00f1a (5), Pa\u00eds Vasco (9), Castilla la Mancha (2), Galicia (7), Extremadura (4), Arag\u00f3n (3) y Andaluc\u00eda.<\/li><li>Entidades beneficiarias en Extremadura:\u00a0Centro de Cirug\u00eda de M\u00ednima Invasi\u00f3n Jes\u00fas Us\u00f3n (<a href=\"https:\/\/www.ccmijesususon.com\/\" target=\"_blank\" rel=\"noopener\">CCMIJU<\/a>); Fundaci\u00f3n Computaci\u00f3n y Tecnolog\u00edas Avanzadas de Extremadura (<a href=\"\/descripcion-la-fundacion\/\">COMPUTAEX<\/a>); Fundaci\u00f3n para la Formaci\u00f3n e Investigaci\u00f3n de los Profesionales de la Salud de Extremadura (<a href=\"https:\/\/saludextremadura.ses.es\/fundesalud\/web\/inicio\" target=\"_blank\" rel=\"noopener\">FundeSalud<\/a>); Universidad de Extremadura (<a href=\"https:\/\/www.unex.es\/\" target=\"_blank\" rel=\"noopener\">UEx<\/a>).<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>En los \u00faltimos a\u00f1os se han logrado relevantes desarrollos biotecnol\u00f3gicos y digitales (inteligencia artificial, supercomputaci\u00f3n, rob\u00f3tica y tecnolog\u00eda de sensores, bioingenier\u00eda, o nanotecnolog\u00eda, entre otros) que est\u00e1n permitiendo la generaci\u00f3n y el an\u00e1lisis masivo de datos \u00f3micos relacionados con la salud y la enfermedad. Esto est\u00e1 llevando a un cambio radical de las herramientas para dise\u00f1ar y producir nuevos sistemas y dispositivos de diagn\u00f3stico, pron\u00f3stico y terapia.<\/p><p>La integraci\u00f3n y adopci\u00f3n de estas tecnolog\u00edas facilitadoras en la industria biotecnol\u00f3gica y de tecnolog\u00edas m\u00e9dicas es donde radica el gran potencial de conseguir una medicina personalizada o de precisi\u00f3n que establezca, para cada individuo, herramientas para la prevenci\u00f3n seg\u00fan su predisposici\u00f3n a determinadas enfermedades, sistemas para el diagn\u00f3stico precoz, y m\u00e9todos para elegir la estrategia terap\u00e9utica que mejor se adapte a cada persona en cada circunstancia.<\/p><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-plan-complementario-de-biotecnologia-aplicada-a-la-salud\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-b7bf36d e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"b7bf36d\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-30920dd elementor-widget elementor-widget-text-editor\" data-id=\"30920dd\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-galemys-alineamiento-ensamblado-y-secuenciacion-del-genoma-del-desman-de-los-pirineos\/\">Galemys: Alineamiento, ensamblado y secuenciaci\u00f3n del genoma del desm\u00e1n de los Pirineos<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Juan Luis Garc\u00eda Zapata, Universidad de Extremadura (<a href=\"https:\/\/www.unex.es\/\" target=\"_blank\" rel=\"noopener\">UEx<\/a>).<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Objetivos:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Se propone realizar la secuenciaci\u00f3n, alineamiento y construcci\u00f3n de una base de datos gen\u00f3mica a partir de extracci\u00f3n de ADN completo del Desm\u00e1n de los Pirineos (Galemys pyrenaicus), as\u00ed como desarrollar la infraestructura bioinform\u00e1tica necesaria para su comparativa con otros genomas pertenecientes a especies de micromam\u00edferos, aplicando metodolog\u00edas de Deep Learning y Aprendizaje por Refuerzo.<\/p><p>Las t\u00e9cnicas gen\u00f3micas de construcci\u00f3n de la base de datos, de procesamiento y comparaci\u00f3n demandan tanto gran capacidad de almacenamiento como gran capacidad de c\u00f3mputo, tanto por volumen de datos como por el uso de algoritmos estad\u00edsticos y combinatorios espec\u00edficos de este campo, lo que implica el uso de instalaciones de altas prestaciones (High performance computing, HPC), as\u00ed como metodolog\u00edas de computaci\u00f3n cient\u00edfica espec\u00edficas en el campo de la bioinform\u00e1tica.<\/p><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-galemys-alineamiento-ensamblado-y-secuenciacion-del-genoma-del-desman-de-los-pirineos\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-1abce5a e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"1abce5a\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-518c65e elementor-widget elementor-widget-text-editor\" data-id=\"518c65e\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-computational-modelling-of-the-lattice-thermal-conductivity-of-alloys-with-thermoelectric-applications\/\">Computational modelling of the lattice thermal conductivity of alloys with thermoelectric applications<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>\u00a0Jose Javier Plata Ramos.\u00a0<a href=\"https:\/\/www.us.es\/\">Universidad de Sevilla.<\/a><\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la Red Espa\u00f1ola de Supercomputaci\u00f3n (<a href=\"https:\/\/www.res.es\/\" target=\"_blank\" rel=\"noopener\">RES<\/a>).<br \/>In our society, more than 66% of generated energy is wasted, most of it as heat. Thermoelectric, TE, devices stand as the most promising technology to recover part of this wasted heat. Traditionally, TE material efficiency is measured by the figure of merit, zT. While there are models designed to predict directly one of the quantities that are related to zT, the biggest challenge is to establish connections between real space (atomic structure, chemical composition and microstructure) and reciprocal space properties (transport properties and zT). Our goal is to connect the variables that can be controlled during the design, synthesis and processing of a TE material with their final transport properties and efficiency.<\/p><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-computational-modelling-of-the-lattice-thermal-conductivity-of-alloys-with-thermoelectric-applications\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-26d7b4f e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"26d7b4f\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-c48b6a2 elementor-widget elementor-widget-text-editor\" data-id=\"c48b6a2\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-modelling-the-npc1-npc2-protein-protein-interaction-using-alphafold-multimer-and-molecular-dynamics-simulations\/\">Modelling the NPC1-NPC2 protein-protein interaction using Alphafold Multimer and Molecular dynamics simulations<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Llabr\u00e9s Prat.\u00a0<a href=\"https:\/\/www.ub.edu\/web\/portal\/es\/\">Universitat de Barcelona<\/a><\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la Red Espa\u00f1ola de Supercomputaci\u00f3n (<a href=\"https:\/\/www.res.es\/\" target=\"_blank\" rel=\"noopener\">RES<\/a>).<\/p><p>Niemann-Pick disease type C is a rare genetic disorder in which cholesterol transport across the body is compromised. Its cause are mutations on the lysosomal NPC1 and NPC2 proteins. The aim of this project is to validate a structural model of the protein-protein interaction of NPC1 and NPC2 proteins using AlphaFold Multimer and state-of-the-art molecular modelling methods.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-modelling-the-npc1-npc2-protein-protein-interaction-using-alphafold-multimer-and-molecular-dynamics-simulations\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-088b64f e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"088b64f\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-17af748 elementor-widget elementor-widget-text-editor\" data-id=\"17af748\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyectos\/proyecto-ab-initio-molecular-dynamics-study-of-bimolecular-processes-in-acid-zeolites\/\">Ab initio molecular dynamics study of bimolecular processes in acid zeolites<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Mercedes Boronat.\u00a0<a href=\"https:\/\/itq.upv-csic.es\/\">Instituto de Tecnolog\u00eda Qu\u00edmica, Universitat Polit\u00e8cnica de Valencia &#8211; CSIC.<\/a><\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la Red Espa\u00f1ola de Supercomputaci\u00f3n (<a href=\"https:\/\/www.res.es\/\" target=\"_blank\" rel=\"noopener\">RES<\/a>).<\/p><p>Many industrially relevant hydrocarbon reactions catalyzed by acid zeolites include in their mechanism bimolecular steps, in which new C-C bonds form by reaction of cationic intermediates with neutral molecules. To design highly specific catalysts able to favor one particular process among some competitive ones, it is necessary to go beyond the static description provided by standard DFT calculations and take into account the mobility of the reactants within the zeolite channels. In this project we intend to investigate, using ab initio molecular dynamics (AIMD) metadynamics simulations, the formation of key dimeric intermediates involved in the diethylbenzene-benzene transalkylation and butene skeletal isomerization reactions, in order to find the zeolite microporous structures able to enhance the rate of such bimolecular steps.<\/p><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyectos\/proyecto-ab-initio-molecular-dynamics-study-of-bimolecular-processes-in-acid-zeolites\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-3baae07 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"3baae07\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-fef3834 elementor-widget elementor-widget-text-editor\" data-id=\"fef3834\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-combining-high-throughput-calculations-and-machine-learning-for-exploring-the-thermoelectric-efficiency-of-large-chemical-spaces-quaternary-metallic-chalcogenides-2\/\">Combining high-throughput calculations and Machine Learning for exploring the thermoelectric efficiency of large chemical spaces: quaternary metallic chalcogenides<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Manuel Alcami.\u00a0<a href=\"https:\/\/www.us.es\/\">Universidad de Sevilla.<\/a><\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la Red Espa\u00f1ola de Supercomputaci\u00f3n (<a href=\"https:\/\/www.res.es\/\" target=\"_blank\" rel=\"noopener\">RES<\/a>).<\/p><p>In our society, more than 66% of generated energy is wasted, most of it as heat. Thermoelectric, TE, devices stand as the most promising technology to recover part of this wasted heat. Traditionally, TE material efficiency is measured by the figure of merit, zT. While there are models designed to predict directly one of the quantities that are related to zT, the biggest challenge is to establish connections between real space (atomic structure, chemical composition and microstructure) and reciprocal space properties (transport properties and zT). Our goal is to connect the variables that can be controlled during the design, synthesis and processing of a TE material with their final transport properties and efficiency.<\/p><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-combining-high-throughput-calculations-and-machine-learning-for-exploring-the-thermoelectric-efficiency-of-large-chemical-spaces-quaternary-metallic-chalcogenides-2\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-e1c455b e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"e1c455b\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-568298e elementor-widget elementor-widget-text-editor\" data-id=\"568298e\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><span style=\"color: #000000;\">\u00a0<a style=\"font-size: 14pt; font-family: Raleway, Helvetica, Arial, sans-serif; font-weight: 600; color: #000000;\" href=\"\/proyecto-theoretical-prediction-of-the-environmental-impact-of-pesticides-4\/\">Theoretical prediction of the environmental impact of pesticides<\/a><\/span><\/div><\/div><\/div><\/div><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Manuel Alcami.\u00a0<a href=\"https:\/\/www.uam.es\/uam\/inicio\">Universidad Aut\u00f3noma de Madrid.<\/a><\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la Red Espa\u00f1ola de Supercomputaci\u00f3n (<a href=\"https:\/\/www.res.es\/\" target=\"_blank\" rel=\"noopener\">RES<\/a>).<\/p><p>The project will develop a large database of quantum chemical calculation of pesticide that will be central part of an expert system to predict the environmental impact of pesticides based exclusively in Quantum Chemistry calculations.<\/p><p>The ultimate goal is to develop and validate new computational tools to predict the impact of pesticides and their degradation products, providing new predictive decision-making tools in environmental policy.<\/p><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-theoretical-prediction-of-the-environmental-impact-of-pesticides-4\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-aa06d9b e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"aa06d9b\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-4e7a46a elementor-widget elementor-widget-text-editor\" data-id=\"4e7a46a\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-in-silico-design-of-light-propelled-molecular-machines-for-the-scrutiny-and-control-of-biological-processes-2\/\">In silico design of light propelled molecular machines for the scrutiny and control of biological processes<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>In\u00e9s Corral.\u00a0<a href=\"https:\/\/www.uam.es\/uam\/inicio\">Universidad Aut\u00f3noma de Madrid.<\/a><\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la Red Espa\u00f1ola de Supercomputaci\u00f3n (<a href=\"https:\/\/www.res.es\/\" target=\"_blank\" rel=\"noopener\">RES<\/a>).<\/p><p>Light-driven molecular machines afford the monitoring and manipulation of biological and biochemical processes within the same spatial and temporal scales of nature, contributing to their understanding and to the identification of potential dysfunctions. The aim of the present activity is to scrutinize the working mechanism of azo-based BODIPY photoswitches, as prototypes for turn-on hypoxia fluorescent probes, and only-photon unidirectional hemithioindigo molecular motors, employing full dimensional molecular dynamics simulations, and state of the art electronic structure approaches. These results are intended to establish structural-photophysical relationships that might serve as a basis for the rational design of novel biomarkers and molecular motors with improved absorbing properties, efficiency and sensitivity.<\/p><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-in-silico-design-of-light-propelled-molecular-machines-for-the-scrutiny-and-control-of-biological-processes-2\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-834ff1b e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"834ff1b\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-8134cf0 elementor-widget elementor-widget-text-editor\" data-id=\"8134cf0\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-studying-the-statistical-properties-of-clusters-of-photonic-particles-by-communication-free-parallel-monte-carlo-simulations-2\/\">Studying the statistical properties of clusters of photonic particles by communication-free parallel Monte Carlo simulations<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Juan Manuel Rius Casals.\u00a0<a href=\"https:\/\/www.upc.edu\/es\">Universitat Polit\u00e8cnica de Catalunya.<\/a><\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la Red Espa\u00f1ola de Supercomputaci\u00f3n (<a href=\"https:\/\/www.res.es\/\" target=\"_blank\" rel=\"noopener\">RES<\/a>).<\/p><p>Clusters of plasmonic nanoparticles enable a multitude of promising applications as surface-enhanced Raman spectroscopy or tailored properties in colloidal assemblies. Computer simulations play a fundamental role in understanding and predicting the electromagnetic properties of these clusters. We employ a novel communication-free parallel Monte Carlo method to efficiently calculate the optical response of clusters of nanoparticles with different configurations. Our objective is to study the properties of these systems from a statistical point of view, with special emphasis on the coupling effects that determine their collective behavior. From the results, we infer simple rules that allow to better understand them and to design particle arrays with the desired properties.<\/p><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-studying-the-statistical-properties-of-clusters-of-photonic-particles-by-communication-free-parallel-monte-carlo-simulations-2\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-8ca8aa6 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"8ca8aa6\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-5571b5f elementor-widget elementor-widget-text-editor\" data-id=\"5571b5f\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-simulations-of-carbon-based-electrodes-for-a-new-generation-of-more-efficient-bateries-2\/\">Simulations of carbon-based electrodes for a new generation of more efficient bateries<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>C\u00e9sar Gonz\u00e1lez.\u00a0<a href=\"https:\/\/www.ucm.es\/\">Universidad Complutense de Madrid.<\/a><\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la Red Espa\u00f1ola de Supercomputaci\u00f3n (<a href=\"https:\/\/www.res.es\/\" target=\"_blank\" rel=\"noopener\">RES<\/a>).<\/p><p>Solid state batteries have recently acquired a great importance due to their advantages respect the other types. Normally, graphite has been chosen as the anode electrode due to the fantastic electronic properties and the low chemical reactivity. Doping the C-based structures with N, an improvement in the electrode performance is obtained. In this project, using precise mechano-quantum calculations based on the Density Functional Theory, we have planned to study graphite and nanotubes doped with different elements (N or B) in order to establish their potential improvement in the electronic interchange as well as the ionic mobility. We will study the inclusion of different types and number of alkaline ions (Li, Na, K) to find the best arrangements and the saturation number. All these parameters will suggest the best future electrode.<\/p><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-simulations-of-carbon-based-electrodes-for-a-new-generation-of-more-efficient-bateries-2\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-b866cc4 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"b866cc4\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-d0bf0da elementor-widget elementor-widget-text-editor\" data-id=\"d0bf0da\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-towards-high-efficient-and-stable-all-inorganic-perovskites-as-sun-light-absorber-materials\/\">Towards high-efficient and stable all-inorganic perovskites as sun-light absorber materials<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Gregorio Garcia Moreno.\u00a0<a href=\"https:\/\/www.upm.es\/\">Universidad Polit\u00e9cnica de Madrid.<\/a><\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la Red Espa\u00f1ola de Supercomputaci\u00f3n (<a href=\"https:\/\/www.res.es\/\" target=\"_blank\" rel=\"noopener\">RES<\/a>).<\/p><p>Hybrid organic-inorganic lead halide perovskites have earned much consideration for their use in photovoltaic devices, wich efficiencies as high as 23%. But yet important challenges need to be overcome: poor stability and the toxicity of Pb. This project purpose the search for suitable perovskite semiconductor materials with enhanced stability, low toxicity as well as improved sunlight conversion efficiencies. Both, the intrinsic stability (replacing the organic cations by inorganic ones) and toxicity (by reducing Pb quantity) problems of perovskite materials can be fixed by adjusting the chemical composition. Thus, the effect of the chemical composition of all-inorganic perovskites with general formula Cs1-aRbPb1-bSnbI2Br on stability and sub-light absorption related-properties by using ab-initio methods.<\/p><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-towards-high-efficient-and-stable-all-inorganic-perovskites-as-sun-light-absorber-materials\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-57dd458 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"57dd458\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-4c15fd9 elementor-widget elementor-widget-text-editor\" data-id=\"4c15fd9\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-combining-high-throughput-calculations-and-machine-learning-for-exploring-the-thermoelectric-efficiency-of-large-chemical-spaces-quaternary-metallic-chalcogenides-2\/\">Combining high-throughput calculations and Machine Learning for exploring the thermoelectric efficiency of large chemical spaces: quaternary metallic chalcogenides<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Jose Javier Plata Ramos. Universidad de Sevilla [<a href=\"https:\/\/www.us.es\/\" target=\"_blank\" rel=\"noopener\">US<\/a>].<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la Red Espa\u00f1ola de Supercomputaci\u00f3n (<a href=\"https:\/\/www.res.es\/\" target=\"_blank\" rel=\"noopener\">RES<\/a>).<\/p><p>In our society, more than 66% of generated energy is wasted, most of it as heat. Thermoelectric, TE, devices stand as the most promising technology to recover part of this wasted heat. Traditionally, TE material efficiency is measured by the figure of merit, zT. While there are models designed to predict directly one of the quantities that are related to zT, the biggest challenge is to establish connections between real space (atomic structure, chemical composition and microstructure) and reciprocal space properties (transport properties and zT). Our goal is to connect the variables that can be controlled during the design, synthesis and processing of a TE material with their final transport properties and efficiency.<\/p><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-combining-high-throughput-calculations-and-machine-learning-for-exploring-the-thermoelectric-efficiency-of-large-chemical-spaces-quaternary-metallic-chalcogenides-2\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-ca455fb e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"ca455fb\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-dc3fb66 elementor-widget elementor-widget-text-editor\" data-id=\"dc3fb66\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-theoretical-prediction-of-the-environmental-impact-of-pesticides-4\/\">Theoretical prediction of the environmental impact of pesticides<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Manuel Alcami. Universidad Aut\u00f3noma de Madrid [<a href=\"https:\/\/www.uam.es\/uam\/inicio\" target=\"_blank\" rel=\"noopener\">UAM<\/a>].<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la Red Espa\u00f1ola de Supercomputaci\u00f3n (<a href=\"https:\/\/www.res.es\/\" target=\"_blank\" rel=\"noopener\">RES<\/a>).<\/p><p>The project will develop a large database of quantum chemical calculation of pesticide that will be central part of an expert system to predict the environmental impact of pesticides based exclusively in Quantum Chemistry calculations. The ultimate goal is to develop and validate new computational tools to predict the impact of pesticides and their degradation products, providing new predictive decision-making tools in environmental policy.<\/p><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-theoretical-prediction-of-the-environmental-impact-of-pesticides-4\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-7e3a5e8 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"7e3a5e8\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-34938d2 elementor-widget elementor-widget-text-editor\" data-id=\"34938d2\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><h2 class=\"title\"><a href=\"\/proyecto-in-silico-design-of-light-propelled-molecular-machines-for-the-scrutiny-and-control-of-biological-processes-2\/\"><span style=\"font-size: 14pt;\">In silico design of light propelled molecular machines for the scrutiny and control of biological processes<\/span><\/a><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores<\/strong>:\u00a0<\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>In\u00e9s Corral P\u00e9rez.\u00a0Universidad Aut\u00f3noma de Madrid [<a href=\"https:\/\/www.uam.es\/\" target=\"_blank\" rel=\"noopener\">UAM<\/a>].<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la Red Espa\u00f1ola de Supercomputaci\u00f3n (<a href=\"https:\/\/www.res.es\/\" target=\"_blank\" rel=\"noopener\">RES<\/a>).<\/p><p>Light-driven molecular machines afford the monitoring and manipulation of biological and biochemical processes within the same spatial and temporal scales of nature, contributing to their understanding and to the identification of potential dysfunctions. The aim of the present activity is to scrutinize the working mechanism of azo-based BODIPY photoswitches, as prototypes for turn-on hypoxia fluorescent probes, and only-photon unidirectional hemithioindigo molecular motors, employing full dimensional molecular dynamics simulations, and state of the art electronic structure approaches. These results are intended to establish structural-photophysical relationships that might serve as a basis for the rational design of novel biomarkers and molecular motors with improved absorbing properties, efficiency and sensitivity.<\/p><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-in-silico-design-of-light-propelled-molecular-machines-for-the-scrutiny-and-control-of-biological-processes-2\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-8687a50 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"8687a50\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-00cc660 elementor-widget elementor-widget-text-editor\" data-id=\"00cc660\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyectos\/proyecto-accelerated-high-throughput-prediction-of-the-figure-of-merit-of-skutterudites\/\">Accelerated high-throughput prediction of the figure of merit of Skutterudites.<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>\u00a0Jose Javier Plata Ramos.\u00a0<a href=\"https:\/\/www.us.es\/\" target=\"_blank\" rel=\"noopener\">Universidad de Sevilla<\/a>.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la Red Espa\u00f1ola de Supercomputaci\u00f3n (<a href=\"https:\/\/www.res.es\/\" target=\"_blank\" rel=\"noopener\">RES<\/a>).<\/p><p>In our society, more than 66% of generated energy is wasted, most of it as heat. Thermoelectric, TE, devices stand as the most promising technology to recover part of this wasted heat. Traditionally, TE material efficiency is measured by the figure of merit, zT. Reducing lattice thermal conductivity, kl, is probably the most straightforward approach to enhance zT. While most of these models are designed to predict directly one of the quantities that are related to zT, the biggest challenge is to establish connections between real space (atomic structure, chemical composition and microstructure) and reciprocal space properties (transport properties and zT). Our goal is to connect the variables that can be controlled during the design, synthesis and processing of a TE material with their final transport properties and efficiency.<\/p><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyectos\/proyecto-accelerated-high-throughput-prediction-of-the-figure-of-merit-of-skutterudites\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-42438d1 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"42438d1\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-e94c60e elementor-widget elementor-widget-text-editor\" data-id=\"e94c60e\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><span style=\"color: #000000; font-size: 14pt;\"><a style=\"font-family: Raleway, Helvetica, Arial, sans-serif; font-weight: 600; color: #000000;\" href=\"\/proyecto-genomic-signatures-of-homologous-recombination-defects-in-prostate-cancer\/\">Genomic signatures of homologous recombination defects in prostate cancer<\/a><\/span><\/div><\/div><\/div><\/div><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Joaqu\u00edn Mateo. Vall d&#8217;Hebron Instituto of Oncology (<a href=\"https:\/\/www.vhio.net\/es\/\" target=\"_blank\" rel=\"noopener\">VHIO<\/a>).<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la Red Espa\u00f1ola de Supercomputaci\u00f3n (<a href=\"https:\/\/www.res.es\/\" target=\"_blank\" rel=\"noopener\">RES<\/a>).<\/p><p>Precision medicine is an unmet need in metastatic prostate cancer (mPC). PARP inhibitors are now approved for the treatment of mPC associated with HRR mutations; however, significant inter-patient variability in outcome exist; better predictive biomarkers for patient stratification are needed. Genomic signatures of HRR defects have putative predictive value in other tumor types, but their clinical significance in prostate cancer is unknown. We will study the distribution of genomic events associated to HRR defects (LOH, LST, NTAI, CNA patterns) and derived signatures. We will test the hypothesise, based on data from our lab, that these signatures are enriched with resistance to hormonal treatments. We will study these features in WES and WGS datasets covering the disease spectrum, from treatment-na\u00efve to late-stage drug resistant mPC.<\/p><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-genomic-signatures-of-homologous-recombination-defects-in-prostate-cancer\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-3fdf3d6 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"3fdf3d6\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-c314123 elementor-widget elementor-widget-text-editor\" data-id=\"c314123\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyectos\/proyecto-accelerated-high-throughput-prediction-of-the-thermal-conductivity-of-skutterudites-by-machine-learning\/\">Accelerated high-throughput prediction of the thermal conductivity of Skutterudites by machine learning<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>\u00a0Jose Javier Plata Ramos.\u00a0<a href=\"https:\/\/www.us.es\/\" target=\"_blank\" rel=\"noopener\">Universidad de Sevilla<\/a>.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la Red Espa\u00f1ola de Supercomputaci\u00f3n (<a href=\"https:\/\/www.res.es\/\" target=\"_blank\" rel=\"noopener\">RES<\/a>).<\/p><p>In our society, more than 66% of generated energy is wasted, most of it as heat. Thermoelectric, TE, devices stand as the most promising technology to recover part of this wasted heat. Traditionally, TE material efficiency is measured by the figure of merit, zT. Reducing lattice thermal conductivity, kl, is probably the most straightforward approach to enhance zT. While most of these models are designed to predict directly one of the quantities that are related to zT, the biggest challenge is to establish connections between real space (atomic structure, chemical composition and microstructure) and reciprocal space properties (transport properties and zT). Our goal is to connect the variables that can be controlled during the design, synthesis and processing of a TE material with their final transport properties and efficiency.<\/p><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyectos\/proyecto-accelerated-high-throughput-prediction-of-the-thermal-conductivity-of-skutterudites-by-machine-learning\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-6c4e4a4 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"6c4e4a4\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-b288314 elementor-widget elementor-widget-text-editor\" data-id=\"b288314\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-investigating-the-effects-of-disease-causing-mutations-on-the-stability-and-dynamic-properties-of-the-human-hint1-protein\/\">Investigating the effects of disease-causing mutations on the stability and dynamic properties of the human Hint1 protein<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Shoshana Wodak.\u00a0<a href=\"https:\/\/vib.be\/vib-vub-center-structural-biology\" target=\"_blank\" rel=\"noopener\">VIB-VUB Center for Structural Biology<\/a>.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la Red Espa\u00f1ola de Supercomputaci\u00f3n (<a href=\"https:\/\/www.res.es\/\" target=\"_blank\" rel=\"noopener\">RES<\/a>).<\/p><p>Mutations of the dimeric Hint1 enzyme are well-known to cause neuropathy associated with neuromyotonia (NMAN). So far, 25 distinct NMAN causative variants have been identified world-wide. Structure-based bioinformatics predictors and in vivo assays revealed that certain variants compromise the protein stability more than the others. In this molecular dynamics (MD) simulation study, we scrutinize the structural dynamics of the wild-type and the single-residue mutant constructs, moreover, the extent of the destabilization effect of disease variants by MD simulations and thermodynamic integration in order to find disease variants that only compromise the stability to the extent that it is rescuable by small molecule stabilizers.<\/p><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-investigating-the-effects-of-disease-causing-mutations-on-the-stability-and-dynamic-properties-of-the-human-hint1-protein\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-6b78f45 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"6b78f45\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-8330280 elementor-widget elementor-widget-text-editor\" data-id=\"8330280\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-computational-modelling-and-design-of-thermoelectric-materials-based-on-metal-chalcogenides-and-oxychalcogenides-the-effects-of-the-chemical-composition\/\">Computational modelling and design of thermoelectric materials based on metal chalcogenides and oxychalcogenides: the effects of the chemical composition<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Jose Javier Plata Ramos.\u00a0Universidad de Sevilla (<a href=\"https:\/\/www.us.es\/\" target=\"_blank\" rel=\"noopener\">US<\/a>).<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la Red Espa\u00f1ola de Supercomputaci\u00f3n (<a href=\"https:\/\/www.res.es\/\" target=\"_blank\" rel=\"noopener\">RES<\/a>).<\/p><p>In our society, more than 66% of generated energy is wasted, most of it as heat. Thermoelectric, TE, devices stand as the most promising technology to recover part of this wasted heat. Traditionally, TE material efficiency is measured by the figure of merit, zT. Reducing lattice thermal conductivity, kl, is probably the most straightforward approach to enhance zT. While most of these models are designed to predict directly one of the quantities that are related to zT, the biggest challenge is to establish connections between real space (atomic structure, chemical composition and microstructure) and reciprocal space properties (transport properties and zT). Our goal is to connect the variables that can be controlled during the design, synthesis and processing of a TE material with their final transport properties and efficiency.<\/p><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-computational-modelling-and-design-of-thermoelectric-materials-based-on-metal-chalcogenides-and-oxychalcogenides-the-effects-of-the-chemical-composition\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-1c32660 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"1c32660\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-f4a529f elementor-widget elementor-widget-text-editor\" data-id=\"f4a529f\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-origin-of-the-selectivity-on-the-conversion-of-co2-on-ceria-supported-ni-catalyst-from-multiscale-simulations\/\">Origin of the selectivity on the conversion of CO2 on ceria supported Ni catalyst from multiscale simulations<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Francesc Illas Riera. Universidad\u00a0de Barcelona (<a href=\"https:\/\/www.ub.edu\/\" target=\"_blank\" rel=\"noopener\">UB<\/a>).<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la Red Espa\u00f1ola de Supercomputaci\u00f3n (<a href=\"https:\/\/www.res.es\/\" target=\"_blank\" rel=\"noopener\">RES<\/a>).<\/p><p>Conversion of atmospheric CO2 is a need to prevent further global warming and also constitutes an opportunity as it can be used as a C1 feedstock for the synthesis of fuels and other commodities. However, the high stability of this molecule requires high active catalysts, often transition metals, leading to a mixture of products. Here, the selectivity of Ni on a ceria support towards CO2 conversion will be studied by multiscale modelling simulations and compared to that of previous studies for extended Ni surfaces and Ni nanoparticles supported on TiC. This will provide useful information for the development of more efficient and selective catalyst.<\/p><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-origin-of-the-selectivity-on-the-conversion-of-co2-on-ceria-supported-ni-catalyst-from-multiscale-simulations\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-71bc427 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"71bc427\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-ed74b34 elementor-widget elementor-widget-text-editor\" data-id=\"ed74b34\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-functional-dynamics-of-human-dna-polymerase-delta\/\">Functional dynamics of human DNA polymerase delta<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Ramon Crehuet. Consejo Superior de Investigaciones Cient\u00edficas (<a href=\"https:\/\/www.csic.es\/\" target=\"_blank\" rel=\"noopener\">CSIC<\/a>)<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la Red Espa\u00f1ola de Supercomputaci\u00f3n (<a href=\"https:\/\/www.res.es\/\" target=\"_blank\" rel=\"noopener\">RES<\/a>).<\/p><p>Although the basic process of DNA replication is well-known, there are still many questions about the roles of specific components and how is the high fidelity of the replication achieved. One of these components is p12, a protein that binds DNA polymerase delta and regulates its activity. In the present work we aim to understand how p12 modulates the activity of its partner polymerase delta by combining structures from Cryo-EM and enhanced sampling simulations. Our hypothesis is that this small protein is able to control the rate at which polymerase delta changes from active to inactive conformations by binding to a critical region of the polymerase.<\/p><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-functional-dynamics-of-human-dna-polymerase-delta\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-9fa7ada e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"9fa7ada\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-e2c10d5 elementor-widget elementor-widget-text-editor\" data-id=\"e2c10d5\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-development-of-a-neural-network-potential-to-reproduce-the-potential-energy-landscape-of-gold-aun-n10-120-anionic-cationic-and-neutral-nanoclusters\/\">Development of a Neural Network Potential to reproduce the potential energy landscape of gold AuN (N=10-120) anionic, cationic and neutral nanoclusters.<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><span style=\"font-size: 14pt;\"><strong>Investigadores:\u00a0<\/strong><\/span><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Andr\u00e9s Vega-Hierro. Unversidad de Valladolid (<a href=\"https:\/\/www.uva.es\/\" target=\"_blank\" rel=\"noopener\">UVa<\/a>).\u00a0<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la Red Espa\u00f1ola de Supercomputaci\u00f3n (<a href=\"https:\/\/www.res.es\/\" target=\"_blank\" rel=\"noopener\">RES<\/a>).<\/p><p>First principles calculations are the standard approach to study nanostructures, which are based on the fundamental laws of quantum mechanics. There are several situations however in which these calculations are not feasible, for instance in large systems containing thousands of atoms, or when exploring the completeness of the energy potential landscape. Thus, other approaches emerge such as the interatomic potentials, or the novel Neural Network Potentials. Based on the Machine Learning technique, these combine the speed of empirical potentials while being substantially more accurate. We have developed a Neural Network Potential for nanostructures, and we aim to apply this scheme to gold nanoclusters, a system arduous to study by ab-initio calculations and challenging to depict through empirical potentials due to its complexity.\u00a0<\/p><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-development-of-a-neural-network-potential-to-reproduce-the-potential-energy-landscape-of-gold-aun-n10-120-anionic-cationic-and-neutral-nanoclusters\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-7743b58 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"7743b58\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-dbff157 elementor-widget elementor-widget-text-editor\" data-id=\"dbff157\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-origin-of-the-selectivity-on-the-conversion-of-co2-on-ceria-supported-ni-catalyst-from-multiscale-simulations\/\" data-wplink-edit=\"true\">Origin of the selectivity on the conversion of CO2 on ceria supported Ni catalyst from multiscale simulations<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Francesc Illas.\u00a0\u00a0Faculty of Chemistry, University of Barcelona (<a href=\"https:\/\/www.ub.edu\/web\/portal\/ca\/\" target=\"_blank\" rel=\"noopener\">UB<\/a>).<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la Red Espa\u00f1ola de Supercomputaci\u00f3n (<a href=\"https:\/\/www.res.es\/\" target=\"_blank\" rel=\"noopener\">RES<\/a>).<\/p><p>Conversion of atmospheric CO<sub>2<\/sub>\u00a0is a need to prevent further global warming and also constitutes an opportunity as it can be used as a C1 feedstock for the synthesis of fuels and other commodities. However, the high stability of this molecule requires high active catalysts, often transition metals, leading to a mixture of products. Here, the selectivity of Ni on a ceria support towards CO<sub>2<\/sub>\u00a0conversion will be studied by multiscale modelling simulations and compared to that of previous studies for extended Ni surfaces and Ni nanoparticles supported on TiC. This will provide useful information for the development of more efficient and selective catalyst.\u00a0<\/p><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-origin-of-the-selectivity-on-the-conversion-of-co2-on-ceria-supported-ni-catalyst-from-multiscale-simulations\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-7361de5 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"7361de5\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-49a852a elementor-widget elementor-widget-text-editor\" data-id=\"49a852a\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><a href=\"\/proyecto-functional-dynamics-of-human-dna-polymerase-delta\/\"><span style=\"font-size: 14pt; color: #000000;\">Functional dynamics of human DNA polymerase delta<\/span><\/a><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Ramon Crehuet. Consejo Superior de Investigaciones Cient\u00edficas (<a href=\"https:\/\/www.csic.es\/\" target=\"_blank\" rel=\"noopener\">CSIC<\/a>)<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la Red Espa\u00f1ola de Supercomputaci\u00f3n (<a href=\"https:\/\/www.res.es\/\" target=\"_blank\" rel=\"noopener\">RES<\/a>).<\/p><p>Although the basic process of DNA replication is well-known, there are still many questions about the roles of specific components and how is the high fidelity of the replication achieved. One of these components is p12, a protein that binds DNA polymerase delta and regulates its activity. In the present work we aim to understand how p12 modulates the activity of its partner polymerase delta by combining structures from Cryo-EM and enhanced sampling simulations. Our hypothesis is that this small protein is able to control the rate at which polymerase delta changes from active to inactive conformations by binding to a critical region of the polymerase.<\/p><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-functional-dynamics-of-human-dna-polymerase-delta\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-c7202ef e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"c7202ef\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-7a35789 elementor-widget elementor-widget-text-editor\" data-id=\"7a35789\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\">\u00a0<\/div><\/div><\/div><\/div><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-development-of-a-neural-network-potential-to-reproduce-the-potential-energy-landscape-of-gold-aun-n10-120-anionic-cationic-and-neutral-nanoclusters\/\">Development of a Neural Network Potential to reproduce the potential energy landscape of gold AuN (N=10-120) anionic, cationic and neutral nanoclusters.<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Andr\u00e9s Vega-Hierro. Unversidad de Valladolid (<a href=\"https:\/\/www.uva.es\/\" target=\"_blank\" rel=\"noopener\">UVa<\/a>).\u00a0<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la Red Espa\u00f1ola de Supercomputaci\u00f3n (<a href=\"https:\/\/www.res.es\/\" target=\"_blank\" rel=\"noopener\">RES<\/a>).<\/p><p>First principles calculations are the standard approach to study nanostructures, which are based on the fundamental laws of quantum mechanics. There are several situations however in which these calculations are not feasible, for instance in large systems containing thousands of atoms, or when exploring the completeness of the energy potential landscape. Thus, other approaches emerge such as the interatomic potentials, or the novel Neural Network Potentials. Based on the Machine Learning technique, these combine the speed of empirical potentials while being substantially more accurate. We have developed a Neural Network Potential for nanostructures, and we aim to apply this scheme to gold nanoclusters, a system arduous to study by ab-initio calculations and challenging to depict through empirical potentials due to its complexity.\u00a0<\/p><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-development-of-a-neural-network-potential-to-reproduce-the-potential-energy-landscape-of-gold-aun-n10-120-anionic-cationic-and-neutral-nanoclusters\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-129028c e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"129028c\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-d10f14a elementor-widget elementor-widget-text-editor\" data-id=\"d10f14a\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-origin-of-the-selectivity-on-the-conversion-of-co2-on-ceria-supported-ni-catalyst-from-multiscale-simulations\/\">Origin of the selectivity on the conversion of CO2 on ceria supported Ni catalyst from multiscale simulations<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Francesc Illas.\u00a0\u00a0Faculty of Chemistry, University of Barcelona (<a href=\"https:\/\/www.ub.edu\/web\/portal\/ca\/\" target=\"_blank\" rel=\"noopener\">UB<\/a>).<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la Red Espa\u00f1ola de Supercomputaci\u00f3n (<a href=\"https:\/\/www.res.es\/\" target=\"_blank\" rel=\"noopener\">RES<\/a>).<\/p><p>Conversion of atmospheric CO<sub>2<\/sub>\u00a0is a need to prevent further global warming and also constitutes an opportunity as it can be used as a C1 feedstock for the synthesis of fuels and other commodities. However, the high stability of this molecule requires high active catalysts, often transition metals, leading to a mixture of products. Here, the selectivity of Ni on a ceria support towards CO<sub>2<\/sub>\u00a0conversion will be studied by multiscale modelling simulations and compared to that of previous studies for extended Ni surfaces and Ni nanoparticles supported on TiC. This will provide useful information for the development of more efficient and selective catalyst.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-origin-of-the-selectivity-on-the-conversion-of-co2-on-ceria-supported-ni-catalyst-from-multiscale-simulations\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-a3d627c e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"a3d627c\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-acd15ab elementor-widget elementor-widget-text-editor\" data-id=\"acd15ab\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-understanding-a-novel-mode-of-non-canonical-cam-activation\/\">Understanding a novel mode of non-canonical CaM activation<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Alvaro Villarroel.\u00a0<a href=\"https:\/\/biofisika.org\/\" target=\"_blank\" rel=\"noopener\">Insituto Biofisika<\/a>\u00a0(Basque Centre for Biophysics), CSIC, UPV\/EHU.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la Red Espa\u00f1ola de Supercomputaci\u00f3n (<a href=\"https:\/\/www.res.es\/\" target=\"_blank\" rel=\"noopener\">RES<\/a>).<\/p><p>Calmodulin (CaM) is the main eukaryotic mediator that confers the ability to respond to intracellular Ca2+ oscillations. CaM binds a huge amount of targets and transmit the Ca2+ signalization in a versatile way, making it a suitable pharmacological target. We are investigating and interaction between a peptide and CaM, which is able to modulate de calcium signal into the cellar excitability dampener Kv7 channel. The aim of this project is to translate the wet experiments to in silico systems to describe at an atomic level how different peptides interact with CaM and translate the calcium signalling to proteins. We believe that this non-canonical mechanism of calcium modulation will provide insights to develop new drug applicable to several diseases, such as, epileptogenic epilepsy and Amyotrophic Lateral Sclerosis (ALS).\u00a0<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-understanding-a-novel-mode-of-non-canonical-cam-activation\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-7b73e64 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"7b73e64\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-446817f elementor-widget elementor-widget-text-editor\" data-id=\"446817f\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><a href=\"\/proyecto-functional-dynamics-of-human-dna-polymerase-delta\/\"><span style=\"font-size: 14pt;\">Functional dynamics of human DNA polymerase delta<\/span><\/a><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Ramon Crehuet.\u00a0Consejo Superior de Investigaciones Cient\u00edficas (<a href=\"https:\/\/www.csic.es\/\" target=\"_blank\" rel=\"noopener\">CSIC<\/a>).<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la Red Espa\u00f1ola de Supercomputaci\u00f3n (<a href=\"https:\/\/www.res.es\/\" target=\"_blank\" rel=\"noopener\">RES<\/a>).<\/p><p>Although the basic process of DNA replication is well-known, there are still many questions about the roles of specific components and how is the high fidelity of the replication achieved. One of these components is p12, a protein that binds DNA polymerase delta and regulates its activity. In the present work we aim to understand how p12 modulates the activity of its partner polymerase delta by combining structures from Cryo-EM and enhanced sampling simulations. Our hypothesis is that this small protein is able to control the rate at which polymerase delta changes from active to inactive conformations by binding to a critical region of the polymerase.\u00a0<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-functional-dynamics-of-human-dna-polymerase-delta\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-ce2e853 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"ce2e853\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-a60bb24 elementor-widget elementor-widget-text-editor\" data-id=\"a60bb24\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-modelizacion-de-reacciones-multicomponente\/\">Modelizaci\u00f3n de reacciones multicomponente<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Carlos Fern\u00e1ndez Marcos. Grupo de investigaci\u00f3n \u00abLaboratorio de Qu\u00edmica Bioorg\u00e1nica y Biof\u00edsica de Membranas\u00bb,\u00a0Facultad de Veterinaria,\u00a0Universidad de Extremadura (<a href=\"https:\/\/www.unex.es\/\" target=\"_blank\" rel=\"noopener\">UEX<\/a>).\u00a0<\/li><\/ul><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-modelizacion-de-reacciones-multicomponente\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-b7d7d40 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"b7d7d40\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-5e51f7b elementor-widget elementor-widget-text-editor\" data-id=\"5e51f7b\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-predicting-thermoelastic-properties-of-2d-materials\/\">Predicting thermoelastic properties of 2D materials<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Jose Javier Plata Ramos.\u00a0<a href=\"https:\/\/www.us.es\/\" target=\"_blank\" rel=\"noopener\">Universidad de Sevilla<\/a>.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la\u00a0<a href=\"https:\/\/www.res.es\/\" target=\"_blank\" rel=\"noopener\">Red Espa\u00f1ola de Supercomputaci\u00f3n<\/a>.<\/p><p>Since the isolation of graphene, two dimensional (2D) materials have attracted the attention due to their exceptional and exotic mechanical, electronic, thermal, and optical properties for potential applications in different key technologies. The prediction of most of their electronic and mechanical properties using DFT commercial packages is considered as routine. However, static DFT calculations does not include thermal effects, so the prediction of materials properties such as elasticity on working conditions and their thermal stability remains as a challenge. In previous periods, we established a new methodology to predict the thermoelastic properties of ultra-high temperature ceramics, reducing the computational cost. In this activity, we strive to calculate the temperature-dependent elastic constants of 2D materials.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-predicting-thermoelastic-properties-of-2d-materials\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-4b4e11c e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"4b4e11c\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-a63cc51 elementor-widget elementor-widget-text-editor\" data-id=\"a63cc51\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-designing-active-materials-toward-formic-acid-reduction\/\">Designing Active Materials toward Formic Acid Reduction<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><span style=\"font-size: 14pt;\"><strong>Investigadores:\u00a0<\/strong><\/span><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Federico Calle Vallejo.\u00a0<a href=\"https:\/\/www.ub.edu\/\" target=\"_blank\" rel=\"noopener\">Universidad de Barcelona<\/a>.\u00a0<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la\u00a0<a href=\"https:\/\/www.res.es\/\" target=\"_blank\" rel=\"noopener\">Red Espa\u00f1ola de Supercomputaci\u00f3n<\/a>.<\/p><p>The electrochemical reduction of formic acid (FAR) is still an unsolved challenge in CO2 transformation into commodities and fuels with high energy densities. Indeed, previous experimental results have shown that several materials reduce CO2 only to formic acid. In this work, using DFT calculations, we will model all the different mechanistic possibilities on several metals and oxides to unravel the special characteristics that efficient FAR catalysts should have. Based on those, we will design and test new materials for FAR to methanol.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-designing-active-materials-toward-formic-acid-reduction\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-1d6a685 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"1d6a685\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-1a14313 elementor-widget elementor-widget-text-editor\" data-id=\"1a14313\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><a href=\"\/proyecto-zr-based-metal-organic-frameworks-for-biomass-valorization\/\"><span style=\"font-size: 14pt;\">Zr-based metal\u2013organic frameworks for biomass valorization<\/span><\/a><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Manuel Ortu\u00f1o.\u00a0<a href=\"http:\/\/www.iciq.org\/\" target=\"_blank\" rel=\"noopener\">ICIQ<\/a>\u00a0(Instituto Catal\u00e1n de Investigaci\u00f3n Qu\u00edmica).<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la\u00a0<a href=\"https:\/\/www.res.es\/\" target=\"_blank\" rel=\"noopener\">Red Espa\u00f1ola de Supercomputaci\u00f3n<\/a>.<\/p><p>While fossil fuels deplete, the use of biomass as renewable resources of carbon atoms becomes a promising solution to develop a sustainable industry. Bridging the gap between homogeneous and heterogeneous catalysis, this project will study metal\u2013organic frameworks based on zirconia nodes to catalyze the valorization of biomass-derived feedstocks into high-value chemicals and fuels. Understanding the reaction mechanisms at atomic level of detail will help to guide future experiments.\u00a0<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-zr-based-metal-organic-frameworks-for-biomass-valorization\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-51684a5 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"51684a5\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-f8dad08 elementor-widget elementor-widget-text-editor\" data-id=\"f8dad08\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-estudios-teoricos-cineticos-y-dinamicos-usando-superficies-de-energia-potencial-en-sistemas-poliatomicos\/\">Estudios te\u00f3ricos cin\u00e9ticos y din\u00e1micos usando superficies de energ\u00eda potencial en sistemas poliat\u00f3micos<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Joaqu\u00edn Espinosa Garc\u00eda, Jos\u00e9 C. Corchado Mart\u00edn-Romo, Cipriano Rangel Delgado, Manuel Monge Palacios, Juan de la C. Garc\u00eda Bern\u00e1ldez, Alberto Cabello S\u00e1nchez y Jos\u00e9 L. Bravo Trinidad. Grupo de investigaci\u00f3n GCYDEX, Universidad de Extremadura (<a href=\"https:\/\/www.unex.es\/\" target=\"_blank\" rel=\"noopener\">UEX<\/a>).<\/p><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>El campo de investigaci\u00f3n se centra en el estudio cin\u00e9tico y din\u00e1mico te\u00f3rico de sistemas poliat\u00f3micos en fase gaseosa, basado en el conocimiento de las superficies de energ\u00eda potencial (SEP). Un reto importante en esta investigaci\u00f3n es la evoluci\u00f3n desde los bien estudiados sistemas \u00e1tomo+di\u00e1tomo a los sistemas poliat\u00f3micos. Las superficies de energ\u00eda potencial desempe\u00f1an un papel central en la completa descripci\u00f3n de un sistema reactivo.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-estudios-teoricos-cineticos-y-dinamicos-usando-superficies-de-energia-potencial-en-sistemas-poliatomicos\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-a315378 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"a315378\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-0740f20 elementor-widget elementor-widget-text-editor\" data-id=\"0740f20\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-exploring-the-role-of-k-as-a-promoter-in-the-water-gas-shift-reaction-and-methanol-synthesis\/\">Exploring the role of K as a promoter in the water-gas shift reaction and methanol synthesis<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Jose Javier Plata Ramos.\u00a0<a href=\"https:\/\/www.us.es\/\" target=\"_blank\" rel=\"noopener\">Universidad de Sevilla<\/a>.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la\u00a0<a href=\"https:\/\/www.res.es\/\" target=\"_blank\" rel=\"noopener\">Red Espa\u00f1ola de Supercomputaci\u00f3n<\/a>.<\/p><p>The activity and selectivity of a heterogeneous catalyst can be substantially affected by the addition of a promoter. In this project, we aim to study the influence of K as a promoter for the WGS reaction and methanol synthesis in different Cu based catalyst. Our previous studies demonstrated that K plays an important role in water dissociation but it is unclear its influence in the whole catalytic cycle from a thermodynamic and kinetic points of view.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-exploring-the-role-of-k-as-a-promoter-in-the-water-gas-shift-reaction-and-methanol-synthesis\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-675d771 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"675d771\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-d822165 elementor-widget elementor-widget-text-editor\" data-id=\"d822165\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-sistema-bioinformatico-de-apoyo-a-la-investigacion-en-la-unificacion-del-patrimonio-genealogico-y-genetico\/\">Sistema bioinform\u00e1tico de apoyo a la investigaci\u00f3n en la unificaci\u00f3n del patrimonio geneal\u00f3gico y gen\u00e9tico<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>\u00c1lvaro Rodr\u00edguez San Pedro. TFG en Grado en Ingenier\u00eda Inform\u00e1tica en Ingenier\u00eda de Software de la\u00a0<a href=\"https:\/\/www.unex.es\/\" target=\"_blank\" rel=\"noopener\">UEx<\/a>. Codirigido por F\u00e9lix Rodr\u00edguez Rodr\u00edguez y Jos\u00e9 Luis Gonz\u00e1lez S\u00e1nchez.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>El desarrollo en el campo de la gen\u00e9tica ha abierto nuevas puertas en el estudio de enfermedades y en el diagn\u00f3stico cl\u00ednico. La medicina de precisi\u00f3n pretende aprovechar esas nuevas capacidades. Aunando el estudio de la variabilidad gen\u00e9tica de los individuos, su entorno y sus h\u00e1bitos de vida, pretende identificar estrategias de tratamiento y prevenci\u00f3n de enfermedades para grupos concretos. En Extremadura, la aplicaci\u00f3n de tales t\u00e9cnicas est\u00e1 supeditada a la disponibilidad de la informaci\u00f3n. Para ello, es necesaria una plataforma que permita la unificaci\u00f3n del patrimonio geneal\u00f3gico y gen\u00e9tico, conjuntamente con los datos cl\u00ednicos.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-sistema-bioinformatico-de-apoyo-a-la-investigacion-en-la-unificacion-del-patrimonio-genealogico-y-genetico\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-118bdda e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"118bdda\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-764e1d1 elementor-widget elementor-widget-text-editor\" data-id=\"764e1d1\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-plataforma-de-integracion-y-gestion-de-datos-geolocalizados-destinados-a-mejorar-la-eficiencia-agraria-de-los-cultivos\/\">Plataforma de integraci\u00f3n y gesti\u00f3n de datos geolocalizados destinados a mejorar la eficiencia agraria de los cultivos<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>\u00c1lvaro Huertas Mart\u00edn. TFG en Grado en Ingenier\u00eda Inform\u00e1tica en Ingenier\u00eda de Software de la\u00a0<a href=\"https:\/\/www.unex.es\/\" target=\"_blank\" rel=\"noopener\">UEx<\/a>. Codirigido por F\u00e9lix Rodr\u00edguez Rodr\u00edguez y Jos\u00e9 Luis Gonz\u00e1lez S\u00e1nchez.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Es un hecho que las nuevas tecnolog\u00edas est\u00e1n llegando con retraso al sector agropecuario en Extremadura, creando una gran desigualdad respecto a otros sectores como la industria alimentaria. Este problema se ve acrecentado ante una demanda de productos del sector agr\u00edcola y ganadero que va en aumento y que resulta en un mercado basado en la importaci\u00f3n de productos del exterior y en la producci\u00f3n de productos de baja calidad. Esto supone un reto para el sector tecnol\u00f3gico de la regi\u00f3n. Es por ello que se deben proponer soluciones para la mejora de la producci\u00f3n agr\u00edcola y ganadera y paliar esta desigualdad entre la oferta y la demanda.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-plataforma-de-integracion-y-gestion-de-datos-geolocalizados-destinados-a-mejorar-la-eficiencia-agraria-de-los-cultivos\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-b75a771 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"b75a771\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-f62e1b7 elementor-widget elementor-widget-text-editor\" data-id=\"f62e1b7\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-prospectic2-aplicacion-de-inteligencia-artificial-big-open-data-y-supercomputacion-al-estudio-de-la-herencia-epigenetica-en-enfermedades-oncologicas\/\">Prosp\u00e9ctic2: Aplicaci\u00f3n de Inteligencia Artificial, Big Open Data y Supercomputaci\u00f3n al Estudio de la Herencia Epigen\u00e9tica en Enfermedades Oncol\u00f3gicas<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li><a href=\"\/descripcion-cenits\/\">C\u00e9nitS<\/a>.<\/li><li><a href=\"http:\/\/www.fotex.es\/\" target=\"_blank\" rel=\"noopener\">FOTEX<\/a>.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Entendiendo que la prospectiva es el conjunto de an\u00e1lisis y estudios realizados con el fin de explorar o predecir el futuro en una determinada materia, el objetivo general del proyecto Prosp\u00e9ctic2, continuidad del proyecto\u00a0<a href=\"\/proyecto-prospectica-big-open-data-para-el-analisis-y-estudio-de-la-influencia-del-entorno-en-enfermedades-oncologicas\/\"><em>Prosp\u00e9ctica: Big Open Data para el an\u00e1lisis y estudio de la influencia del entorno en enfermedades oncol\u00f3gicas<\/em><\/a>, ser\u00e1 aplicar las tecnolog\u00edas inform\u00e1ticas con car\u00e1cter prospectivo para enfrentarse a la influencia que las condiciones del entorno tienen en la aparici\u00f3n y prevalencia de ciertas enfermedades oncol\u00f3gicas, y el papel que desempe\u00f1a el sistema inmunol\u00f3gico.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-prospectic2-aplicacion-de-inteligencia-artificial-big-open-data-y-supercomputacion-al-estudio-de-la-herencia-epigenetica-en-enfermedades-oncologicas\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-bc533d9 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"bc533d9\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-a56ea1d elementor-widget elementor-widget-text-editor\" data-id=\"a56ea1d\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-cultivdat2-desarrollo-sostenible-aplicando-modelos-predictivos-al-cultivo-de-datos-agrarios\/\">CultivDat2: Desarrollo sostenible aplicando modelos predictivos al cultivo de datos agrarios<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li><a href=\"\/descripcion-cenits\/\">C\u00e9nitS<\/a>.<\/li><li><a href=\"https:\/\/casat.es\/\">CASAT<\/a>.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>El objetivo general del proyecto\u00a0<a href=\"\/proyecto-cultivdata\/\" target=\"_blank\" rel=\"noopener\">CultivData<\/a>\u00a0est\u00e1 centrado en el an\u00e1lisis, dise\u00f1o y pilotaje de un prototipo de plataforma inform\u00e1tica para el \u201ccultivo\u201d de datos agrarios abiertos y p\u00fablicos aspirando a la excelencia en el sector agrario extreme\u00f1o. La plataforma capta datos de muy diversas fuentes y formatos para, una vez obtenidos, aplicar t\u00e9cnicas de Big Data con el fin de crear modelos de datos que permitan obtener conocimiento que pueda resultar de utilidad para los grupos de inter\u00e9s del sector agroalimentario. Este conocimiento permitir\u00e1 tomar decisiones fundamentales para mejorar la calidad de los productos, ampliar la productividad de las explotaciones y aspirar a la eficiencia en la comercializaci\u00f3n.<\/p><p>Se est\u00e1 obteniendo en CultivData una metodolog\u00eda y un prototipo en el que las t\u00e9cnicas anal\u00edticas de Big Data son un requerimiento muy importante, dados los vol\u00famenes de datos y variantes de formatos. La velocidad de respuesta y las simulaciones casi en tiempo real requieren de la potencia de procesamiento HPC (High Performance Computing) que el supercomputador\u00a0<a href=\"\/lusitania\/lusitania-ii\/\">LUSITANIA II<\/a>\u00a0puede aportar a este tipo de proyectos.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-cultivdat2-desarrollo-sostenible-aplicando-modelos-predictivos-al-cultivo-de-datos-agrarios\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-fb5b80d e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"fb5b80d\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-031e63c elementor-widget elementor-widget-text-editor\" data-id=\"031e63c\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-predicting-thermoelastic-properties-of-materials-with-advanced-exchange-correlation-functionals\/\">Predicting thermoelastic properties of materials with advanced exchange correlation functionals<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Jose Javier Plata Ramos.\u00a0<a href=\"http:\/\/www.us.es\/\" target=\"_blank\" rel=\"noopener\">Universidad de Sevilla<\/a>.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la\u00a0<a href=\"https:\/\/www.res.es\/\" target=\"_blank\" rel=\"noopener\">Red Espa\u00f1ola de Supercomputaci\u00f3n<\/a>.<\/p><p>Thermoelastic properties of materials are essential to understand the behavior of Earth-forming minerals at high pressures and temperatures or the use of ultra-high temperature ceramics at aerospace applications. However, the computational prediction of the properties is extremely expensive. We have developed a methodology to finite temperature properties such as elastic constants and other mechanical properties such as bulk modulus, shear modulus, Poisson ratio, Young modulus or elastic anisotropy, reducing the computational cost of traditional approaches. However, many questions related to the performance of different exchange correlation functions to predict these properties remains unsolved. In this activity, we strive to calculate thermoelastic properties of a benchmark of materials using different functionals.\u00a0<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-predicting-thermoelastic-properties-of-materials-with-advanced-exchange-correlation-functionals\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-4069978 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"4069978\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-ba86406 elementor-widget elementor-widget-text-editor\" data-id=\"ba86406\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\">\u00a0<\/div><\/div><\/div><\/div><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-estudios-computacionales-para-simulacion-de-reacciones-quimicas\/\">Estudios computacionales para simulaci\u00f3n de reacciones qu\u00edmicas<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Guadalupe Silvero Enr\u00edquez, Ignacio L\u00f3pez-Coca Mart\u00edn y Mar\u00eda Jos\u00e9 Ar\u00e9valo Caballero. Grupo de investigaci\u00f3n Laboratory of Applied and Sustainable Organic Chemistry (LABASOC). Departamento de Qu\u00edmica Org\u00e1nica e Inorg\u00e1nica del Semidistrito de C\u00e1ceres de la Universidad de Extremadura (<a href=\"https:\/\/www.unex.es\/\" target=\"_blank\" rel=\"noopener\">UEX<\/a>).<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Estudio, desde un punto de vista te\u00f3rico, de reacciones qu\u00edmicas, para optimizar las condiciones de reacci\u00f3n y los tiempos y rendimientos experimentales y llegar a comprender y explicar los mecanismos por los que transcurren determinados procesos. Utilizaci\u00f3n del paquete de programas Gaussian para abordar el estudio.<\/p><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-estudios-computacionales-para-simulacion-de-reacciones-quimicas\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-cdc1ed4 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"cdc1ed4\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-2f1ba58 elementor-widget elementor-widget-text-editor\" data-id=\"2f1ba58\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\">\u00a0<\/div><\/div><\/div><\/div><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyectos\/proyecto-glicoconjugados-basados-en-el-esqueleto-de-aminopoliol-estructura-agregacion-y-modificacion-superficial\/\">Glicoconjugados basados en el esqueleto de aminopoliol. Estructura agregaci\u00f3n y modificaci\u00f3n superficial<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Pedro Cintas Moreno, Mart\u00edn \u00c1valos Gonz\u00e1lez, Reyes Babiano Caballero, David Cantillo Nieves, Jos\u00e9 Luis Jim\u00e9nez Requejo, Rafael Fernando Mart\u00ednez V\u00e1zquez, Juan Carlos Palacios Albarr\u00e1n y Esther Matamoros Castellano. Grupo de investigaci\u00f3n QUOREX, Universidad de Extremadura (<a href=\"https:\/\/www.unex.es\/\" target=\"_blank\" rel=\"noopener\">UEX<\/a>).<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>QUOREX est\u00e1 integrado por docentes e investigadores cuyas l\u00edneas de trabajo se encuentran financiadas a trav\u00e9s de proyectos nacionales y regionales. El grupo trabaja en las siguientes l\u00edneas de investigaci\u00f3n, en las cu\u00e1les la supercomputaci\u00f3n es una herramienta importante: estudio de reactividad qu\u00edmica en mol\u00e9culas org\u00e1nicas, a elevado nivel te\u00f3rico (en particular procesos regio-, enantio- y diastereoselectivos catalizados por complejos met\u00e1licos); dise\u00f1o computacional de c\u00e1psulas oligom\u00e9ricas como medios de reacci\u00f3n organizados, evaluando transformaciones selectivas de inclusi\u00f3n y reconocimiento molecular; simulaci\u00f3n del centro activo de enzimas catal\u00edticos. Estudio de la interacci\u00f3n con mol\u00e9culas org\u00e1nicas peque\u00f1as que pueden actuar como agonistas o antagonistas del enzima; y modelizaci\u00f3n de las interacciones de glicol\u00edpidos y sustancias anfip\u00e1ticas derivadas de carbohidratos con superficies met\u00e1licas. Entre los objetivos alcanzados en este proyecto destacan los siguientes:<\/p><ul><li>Una de las l\u00edneas de investigaci\u00f3n se ha centrado en la s\u00edntesis y estudio estructural de bases de Schiff generadas por condensaci\u00f3n de aldeh\u00eddos arom\u00e1ticos con aminas de diferente naturaleza (arom\u00e1ticas, alif\u00e1ticas, aminopolioles y aminoheterociclos). El estudio estructural, basado en experiencias de difracci\u00f3n de rayos X y de resonancia magn\u00e9tica nuclear, se ha completado con estudios te\u00f3ricos llevados a cabo a nivel DFT, en fase gaseosa y en disoluci\u00f3n, que han permitido realizar un completo an\u00e1lisis de los equilibrios iminaenamina en disoluci\u00f3n y en estado s\u00f3lido.<\/li><li>Se ha realizado el estudio de los equilibrios tautom\u00e9ricosimina-enamina en varias bases de Schiff derivadas del aminopolioltris (hidroximetil) aminometano. A trav\u00e9s de c\u00e1lculos te\u00f3ricos realizados utilizando los m\u00e9todos B3LYP\/6-31G* y M06-2X\/6-311++G** se ha determinado la estabilidad relativa de cada uno de los taut\u00f3meros, as\u00ed como la del estado de transici\u00f3n correspondiente a su interconversi\u00f3n. Los resultados obtenidos est\u00e1n de acuerdo con la existencia de estructuras enam\u00ednicas preferentemente en estado s\u00f3lido, si bien la tranformaci\u00f3nimina-enamina debe tener lugar con gran facilidad dada la baja barrera de activaci\u00f3n encontrada para dicha transformaci\u00f3n (&lt; 8 kcal.mol-1). A trav\u00e9s de un protocolo computacional se ha modelado la estructura cristalina, lo que ha puesto de manifiesto la mayor estabilidad de la forma enam\u00ednica en el ret\u00edculo cristalino, hecho que concuerda totalmente con los datos obtenidos a trav\u00e9s de difracci\u00f3n de rayos X de monocristal.<\/li><\/ul><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyectos\/proyecto-glicoconjugados-basados-en-el-esqueleto-de-aminopoliol-estructura-agregacion-y-modificacion-superficial\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-2ed12cd e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"2ed12cd\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-ee925d8 elementor-widget elementor-widget-text-editor\" data-id=\"ee925d8\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-predicting-temperature-dependent-elastic-constants-for-ultra-high-temperature-ceramics\/\">Predicting temperature-dependent elastic constants for ultra-high temperature ceramics<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Jose Javier Plata Ramos.\u00a0<a href=\"http:\/\/www.us.es\/\" target=\"_blank\" rel=\"noopener\">Universidad de Sevilla<\/a>.\u00a0<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la\u00a0<a href=\"https:\/\/www.res.es\/\" target=\"_blank\" rel=\"noopener\">Red Espa\u00f1ola de Supercomputaci\u00f3n<\/a>.<\/p><p>Ultra-high temperature ceramics, UHTCs, are key components of materials used in extreme conditions for aerospace applications. However, the characterisation of these materials at working conditions is extremely expensive and there are few laboratories over the world with the required facilities for that task. Although elastic constant at 0 K are calculated routinely by first principles, temperature-dependent elastic constant calculations are still a difficult challenge because of the lack of well stablished approaches and the high computational cost of these methodologies. In this activity, we strive to calculate the temperature-dependent elastic constants of UHTC materials.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-predicting-temperature-dependent-elastic-constants-for-ultra-high-temperature-ceramics\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-809ce15 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"809ce15\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-fa9e5a3 elementor-widget elementor-widget-text-editor\" data-id=\"fa9e5a3\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-photo-sensitization-of-doped-ferroelectric-oxides-using-a-high-throughput-framework\/\">Photo-sensitization of doped ferroelectric oxides using a high-throughput framework.<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Jose Javier Plata Ramos.\u00a0<a href=\"http:\/\/www.us.es\/\" target=\"_blank\" rel=\"noopener\">Universidad de Sevilla<\/a>.\u00a0<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la\u00a0<a href=\"https:\/\/www.res.es\/\" target=\"_blank\" rel=\"noopener\">Red Espa\u00f1ola de Supercomputaci\u00f3n<\/a>.<\/p><p>Perovskites have revolutionized solar cell research obtaining efficiencies up to 22% in less than 10 years. In contrast to conventional solar cells, the efficiency of this new generation of solar cells is not controlled by the Shockley-Queisser limit. Ferroelectric materials exhibit a spontaneous electric polarization facilitating the excited carrier separation which is known as bulk photovoltaic effect. While ferroelectric oxides perovskites excel separating effectively excited charges, thy are far for being good sunlight harvesters. Different strategies have been proposed to tune their electronic properties, but doping is the most common route to modify their electronic properties. In this activity, we strive to apply high-throughput techniques to tune the electronic structure of ferroelectric oxides by doping.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-photo-sensitization-of-doped-ferroelectric-oxides-using-a-high-throughput-framework\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-11c619e e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"11c619e\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-e04758b elementor-widget elementor-widget-text-editor\" data-id=\"e04758b\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-discovery-of-new-peptides-to-rescue-the-mutated-p53-tetramer\/\">Discovery of new peptides to rescue the mutated p53 tetramer<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Ernest Giralt Lled\u00f3.\u00a0<a href=\"https:\/\/www.irbbarcelona.org\/es\" target=\"_blank\" rel=\"noopener\">Institute for Research in Biomedicine (IRB)<\/a>.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la\u00a0<a href=\"https:\/\/www.res.es\/\" target=\"_blank\" rel=\"noopener\">Red Espa\u00f1ola de Supercomputaci\u00f3n<\/a>.<\/p><p>Tetramer formation of p53 (TP53) is essential for its tumor suppressor function. The p53 not only acts as a tumor suppressor protein by inducing cell cycle arrest<br \/>and apoptosis. More than 50% of human tumors have TP53 gene mutations, and most of them are missense mutations that reduce tumor suppressor activity of<br \/>p53 by destabilizing the TP53 formation. A new therapeutical intervention where an active peptide is able to stabilize TP53 tetramers and re-store functional protective activity of p53 is pursued in this project by combining state-of-the-art experimental and computational approaches.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-discovery-of-new-peptides-to-rescue-the-mutated-p53-tetramer\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-116594f e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"116594f\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-8d196f1 elementor-widget elementor-widget-text-editor\" data-id=\"8d196f1\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-discovery-of-p53-tetramer-stabilization-peptides\/\">Discovery of p53 tetramer stabilization peptides<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Ernest Giralt Lled\u00f3.\u00a0<a href=\"https:\/\/www.irbbarcelona.org\/\" target=\"_blank\" rel=\"noopener\">Institute for Research in Biomedicine<\/a>\u00a0(IRB).<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la\u00a0<a href=\"https:\/\/www.res.es\/\" target=\"_blank\" rel=\"noopener\">Red Espa\u00f1ola de Supercomputaci\u00f3n<\/a>.<\/p><p>Tetramer formation of p53 (TP53) is essential for its tumor suppressor function. The p53 not only acts as a tumor suppressor protein by inducing cell cycle arrest and apoptosis. More than 50% of human tumors have TP53 gene mutations, and most of them are missense mutations that reduce tumor suppressor activity of p53 by destabilizing the TP53 formation. A new therapeutical intervention where an active peptide is able to stabilize TP53 tetramers and re-store functional protective activity of p53 is pursued in this project by combining state-of-the-art experimental and computational approaches.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-discovery-of-p53-tetramer-stabilization-peptides\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-0874c34 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"0874c34\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-aca42bc elementor-widget elementor-widget-text-editor\" data-id=\"aca42bc\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-prospectica-big-open-data-para-el-analisis-y-estudio-de-la-influencia-del-entorno-en-enfermedades-oncologicas\/\">Prosp\u00e9ctica: Big Open Data para el an\u00e1lisis y estudio de la influencia del entorno en enfermedades oncol\u00f3gicas<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>\u00a0CLOUDEX, S.L.<\/li><li><a href=\"\/descripcion-cenits\/\">C\u00e9nitS<\/a>.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>El programa de Innovaci\u00f3n y Talento (PIT), promovido por la Consejer\u00eda de Educaci\u00f3n y Empleo de la Junta de Extremadura, y destinado a la contrataci\u00f3n de desempleados menores de 30 a\u00f1os, combina la formaci\u00f3n de tecn\u00f3logos con las pr\u00e1cticas profesionales en empresas privadas. Su objetivo es facilitar la inserci\u00f3n laboral y potenciar las capacidades del talento en las siguientes \u00e1reas: agroalimentaria, tecnolog\u00edas de la informaci\u00f3n y la comunicaci\u00f3n, turismo, salud, energ\u00edas limpias, investigaci\u00f3n b\u00e1sica, humanidades y ciencias sociales, econom\u00eda verde, econom\u00eda circular y bioeconom\u00eda. La duraci\u00f3n de cada proyecto concedido es de 9 meses, de los cuales, el 25% consiste en un proceso formativo impartido y tutorizado en C\u00e9nitS, mientras que el 75% restante se destina al desarrollo de trabajo en las empresas privadas correspondientes. La formaci\u00f3n en C\u00e9nitS tiene por objeto la mejora y adquisici\u00f3n de competencias y capacidades, para el desempe\u00f1o posterior de actividades como tecn\u00f3logos en las empresas seleccionadas, incluyendo adem\u00e1s formaci\u00f3n espec\u00edfica en competencias colaborativas. Se muestran a continuaci\u00f3n los cuatro proyectos principales:<\/p><p>Entendiendo que la prospectiva es el conjunto de an\u00e1lisis y estudios realizados con el fin de explorar o predecir el futuro en una determinada materia, el objetivo general del proyecto Prosp\u00e9ctica ser\u00e1 aplicar las tecnolog\u00edas inform\u00e1ticas con car\u00e1cter prospectivo para enfrentarse a la influencia que las condiciones del entorno tienen en la aparici\u00f3n y prevalencia de ciertas enfermedades oncol\u00f3gicas, y el papel que desempe\u00f1a el sistema inmunol\u00f3gico.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-prospectica-big-open-data-para-el-analisis-y-estudio-de-la-influencia-del-entorno-en-enfermedades-oncologicas\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-584be4a e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"584be4a\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-1fbaa42 elementor-widget elementor-widget-text-editor\" data-id=\"1fbaa42\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-sistema-ciberfisico-para-la-optimizacion-de-una-explotacion-agropecuaria\/\">Sistema Ciberf\u00edsico para la Optimizaci\u00f3n de una Explotaci\u00f3n Agropecuaria<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Juan Francisco Bermejo y Jos\u00e9 Luis Gonz\u00e1lez (C\u00e9nitS-COMPUTAEX) y F\u00e9lix R. Rodr\u00edguez (Escuela Polit\u00e9cnica de C\u00e1ceres, Universidad de Extremadura).<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>El desarrollo de la agricultura, comparada con otras \u00e1reas, se encuentra retrasado y avanza lentamente. Adem\u00e1s, en los pr\u00f3ximos a\u00f1os deber\u00e1 enfrentarse al reto de abastecer a una poblaci\u00f3n mundial en crecimiento al mismo tiempo que se disminuyen las hect\u00e1reas cultivables por persona. Esto implica que se debe aumentar considerablemente la productividad.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-sistema-ciberfisico-para-la-optimizacion-de-una-explotacion-agropecuaria\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-d4ee7a4 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"d4ee7a4\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-3456f53 elementor-widget elementor-widget-text-editor\" data-id=\"3456f53\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-high-throughput-search-of-dopants-for-efficient-ferroelectric-oxide-based-solar-cells\/\">High-throughput search of dopants for efficient ferroelectric oxide based solar cells<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Jose Javier Plata Ramos. Universidad de Sevilla.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la Red Espa\u00f1ola de Supercomputaci\u00f3n (<a href=\"https:\/\/www.res.es\/\" target=\"_blank\" rel=\"noopener\">RES<\/a>).<\/p><p>Photovoltaics, PV, devices performance are based on 3 main features: a) efficient light absorption, b) effective charge separation and c) fast transport and charge extraction. Conventional solar cells are good light harvesters but are limited by the Shockley-Queisser limit because carriers are separated by the internal electric field at the p-n junction. Ferroelectric materials, on the other hand, present a spontaneous electric polarization, providing an alternative way to separate excited carriers. Ferrolectric oxide perovskites also present hindrances that should be overcome. Reducing the bandgap from 2-3 eV to 1.5 eV is the main goal, being doping or substitution of the A and B sites, the most common strategy. In this activity, we strive to use high-throughput techniques to tune the bandgap of ferroelectric oxides by doping.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-high-throughput-search-of-dopants-for-efficient-ferroelectric-oxide-based-solar-cells\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t<div class=\"elementor-element elementor-element-e09c223 elementor-widget elementor-widget-text-editor\" data-id=\"e09c223\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-dft-simulations-on-the-study-of-the-dielectric-function-of-novel-nanostructured-materials\/\">DFT simulations on the study of the dielectric function of novel nanostructured materials<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Francesca Peir\u00f3.\u00a0Universitat de Barcelona.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la Red Espa\u00f1ola de Supercomputaci\u00f3n (<a href=\"https:\/\/www.res.es\/\" target=\"_blank\" rel=\"noopener\">RES<\/a>).<\/p><p>In the present work, the anisotropic electrical conductivity of GaInP CuPtB type ordered layers will be assessed by using in-situ biasing in a Transmission Electron Microscopy (TEM). The electrical conductivity of GaInP thin films with different degree of order (controlled by the amount of Sb flux during the growth) will be measured in the orthogonal [110] and [1-10] directions. The anisotropy will be evaluated as a function of the density of ordered domains and antiphase boundaries and the results will be discussed in the light of DFT simulations.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-dft-simulations-on-the-study-of-the-dielectric-function-of-novel-nanostructured-materials\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-dd8d6e6 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"dd8d6e6\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-7b43fde elementor-widget elementor-widget-text-editor\" data-id=\"7b43fde\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-analisis-de-datos-geneticos-ambientales-y-de-comportamiento-para-la-predictibilidad-de-enfermedades-oncologicas-mediante-ultrasecuenciacion-genetica-y-aplicando-paradigmas-hpc-cloud-comput\/\">An\u00e1lisis de datos gen\u00e9ticos, ambientales y de comportamiento para la predictibilidad de enfermedades oncol\u00f3gicas mediante ultrasecuenciaci\u00f3n gen\u00e9tica y aplicando paradigmas HPC, Cloud Computing, Big Data y Open Data<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Equipo de\u00a0<a href=\"\/descripcion-cenits\/\">C\u00e9nitS<\/a>&#8211;<a href=\"\/descripcion-la-fundacion\/\">COMPUTAEX<\/a>.<\/li><li><a href=\"http:\/\/cloudex.es\/\" target=\"_blank\" rel=\"noopener\">Cloudex<\/a>\u00a0S.L.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>El objetivo principal del proyecto \u200bes crear un novedoso modelo de prestaci\u00f3n de servicios que, a trav\u00e9s de tecnolog\u00edas de cloud computing, y con t\u00e9cnicas Big Data y Open Data, permita a especialistas en oncolog\u00eda aplicar medicina de precisi\u00f3n gracias a la ultrasecuenciaci\u00f3n gen\u00e9tica y a la supercomputaci\u00f3n (HPC &#8211; High Performance Computing).<\/p><p>El c\u00e1ncer abarca realmente un complejo grupo de enfermedades con una gran variedad de causas posibles, las cuales incluyen factores gen\u00e9ticos, factores del estilo de vida, como el tabaquismo (alteraciones epigen\u00e9ticas cr\u00f3nicas inducidas por el humo del cigarrillo en oncogen), la alimentaci\u00f3n, el ejercicio y la depresi\u00f3n, factores sobre ciertos tipos de infecciones como pueden ser las provocadas por el virus del papiloma humano (detr\u00e1s del 10% de los c\u00e1nceres de mujeres) y elicobacter Pylori, y factores relacionados con el entorno, como la exposici\u00f3n a ciertas sustancias qu\u00edmicas y radiaciones (por ejemplo, el rad\u00f3n, un gas natural que emana de las rocas, responsable entre el 3% y el 14% de las muertes por c\u00e1ncer de pulm\u00f3n, seg\u00fan la OMS).<\/p><p>As\u00ed, el an\u00e1lisis gen\u00e9tico, se ha convertido en la prioridad y objetivo de diversos estudios e investigaciones para la determinaci\u00f3n precoz de la enfermedad, el pron\u00f3stico y el tratamiento (siendo clave conocer el perfil molecular para la elecci\u00f3n de la terapia m\u00e1s adecuada). Este an\u00e1lisis permite ofrecer un tratamiento m\u00e1s adecuado, al ser personalizado, y aumentar as\u00ed la supervivencia. De este modo, se ha descubierto que alrededor de un 10-15 % de los c\u00e1nceres (seg\u00fan el tipo) son causados por mutaciones germinales.\u00a0La secuenciaci\u00f3n permite, por tanto, no s\u00f3lo el beneficio del propio paciente de la enfermedad, sino, por ejemplo, el del resto de miembros de su familia, mediante la toma de medidas preventivas.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-analisis-de-datos-geneticos-ambientales-y-de-comportamiento-para-la-predictibilidad-de-enfermedades-oncologicas-mediante-ultrasecuenciacion-genetica-y-aplicando-paradigmas-hpc-cloud-comput\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-113d963 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"113d963\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-153ac1c elementor-widget elementor-widget-text-editor\" data-id=\"153ac1c\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><a href=\"\/proyecto-the-mechanism-of-the-two-step-spin-transition-of-a-thiazyl-diradical-based-material-presenting-geometrical-frustration\/\">The mechanism of the two-step spin-transition of a thiazyl-diradical-based material presenting geometrical frustration.<\/a><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Juan Jose Novoa Vide. Facultat de Qu\u00edmica. Universitat de Barcelona.<\/p><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la\u00a0<a href=\"https:\/\/www.res.es\/\" target=\"_blank\" rel=\"noopener\">Red Espa\u00f1ola de Supercomputaci\u00f3n<\/a>.\u00a0<\/p><p>Recent years have witnessed a growing interest in the research of molecular materials that can be switched between two different states through the application of an external stimulus (e.g. heat, light) because these materials have a great potential for application in sensors, displays and in information technology. The main goal of this Activity is to understand the mechanisms underlying the two-step spin transition of a recently-prepared material made of bis-dithiadiazolyl diradicals and to decipher the origin of the geometrical frustration of one of its phases. Our results will provide useful insights on how to properly harness labile pi-pi interactions in stacks of diradicals in order to develop new diradical-based switchable materials.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-the-mechanism-of-the-two-step-spin-transition-of-a-thiazyl-diradical-based-material-presenting-geometrical-frustration\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-85f155f e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"85f155f\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-1787a24 elementor-widget elementor-widget-text-editor\" data-id=\"1787a24\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-elucidacion-y-estudios-mecanisticos-en-reactividad-organica-y-organometalica\/\">Elucidaci\u00f3n y estudios mecan\u00edsticos en reactividad org\u00e1nica y organomet\u00e1lica<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Jes\u00fas D\u00edaz \u00c1lvarez. Laboratorio de Qu\u00edmica Bioorg\u00e1nica y Biof\u00edsica de Membranas. Universidad de Extremadura.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Objetivos:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Los objetivos de los estudios computacionales que se pretenden llevar a cabo son los de apoyar, estudiar y prever la reactividad org\u00e1nica que se est\u00e1 realizando en el\u00a0Laboratorio de Qu\u00edmica Bioorg\u00e1nica y Biof\u00edsica de Membranas de la Universidad de Extremadura.<\/p><p>Por un lado las reacciones multicomponentes para la s\u00edntesis de productos con potencial actividad biol\u00f3gica son objeto de este grupo de investigaci\u00f3n desde hace unos a\u00f1os. Este proyecto ha reportado la publicaci\u00f3n de bastantes art\u00edculos en los \u00faltimos a\u00f1os, existiendo un campo amplio aun por explorar. La exploraci\u00f3n debe ser experimental pero una aproximaci\u00f3n te\u00f3rica puede ayudar a enfocar el problema, o a su vez a explicar los resultados experimentales obtenidos. Por ello en los \u00faltimos art\u00edculos cient\u00edficos publicados siempre ha habido una parte importante dedicada a los c\u00e1lculos computacionales realizados.<\/p><p>En segundo lugar y no menos importante, la incorporaci\u00f3n de distintos metales de transici\u00f3n unidos a ligandos org\u00e1nicos hace variar la reactividad de manera muy dependiente del metal as\u00ed como del ligando, lo que abre la puerta a qu\u00edmica muy novedosa y de gran inter\u00e9s.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-elucidacion-y-estudios-mecanisticos-en-reactividad-organica-y-organometalica\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-f8aabe4 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"f8aabe4\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-13cc3cf elementor-widget elementor-widget-text-editor\" data-id=\"13cc3cf\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><a href=\"\/proyecto-cultivdata\/\">CultivData<\/a><\/h2><div class=\"contextual-links-wrapper contextual-links-processed\">\u00a0<\/div><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Equipo <a href=\"\/descripcion-cenits\/\">C\u00e9nitS<\/a>&#8211;<a href=\"\/descripcion-la-fundacion\/\">COMPUTAEX<\/a>.<\/p><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Extremadura es reconocida como una regi\u00f3n que aporta productos agr\u00edcolas y ganaderos de gran calidad. Adem\u00e1s, los \u00faltimos a\u00f1os se han caracterizado por el notable esfuerzo que ha realizado la regi\u00f3n para no perder la revoluci\u00f3n tecnol\u00f3gica y as\u00ed, las TIC se han incorporado a todos los \u00e1mbitos de la sociedad.<\/p><p>Tal vez el sector agropecuario haya sido de los de menor adopci\u00f3n de las nuevas t\u00e9cnicas, por lo\u00a0que hay un gran recorrido para que la agricultura y la ganader\u00eda mejoren sus m\u00e9todos tradicionales, sin que ello suponga una merma en la calidad que se reconoce internacionalmente a sus productos.<\/p><p>El proyecto CultivData pretende desarrollar e implementar herramientas que permitan mejorar no s\u00f3lo la eficiencia, sino tambi\u00e9n la productividad, la sostenibilidad y la calidad del sector agropecuario extreme\u00f1o.<\/p><p>La propuesta presenta una investigaci\u00f3n de car\u00e1cter transversal de las Tecnolog\u00edas de la Informaci\u00f3n y las Comunicaciones, y su aplicaci\u00f3n en la sociedad, que conlleva la interacci\u00f3n con \u00e1reas del conocimiento como la agricultura, la eficiencia en la utilizaci\u00f3n de los recursos naturales y la optimizaci\u00f3n de la calidad de los productos derivados de las explotaciones agr\u00edcolas.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-origin-of-the-selectivity-on-the-conversion-of-co2-on-ceria-supported-ni-catalyst-from-multiscale-simulations\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-a157473 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"a157473\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-f727882 elementor-widget elementor-widget-text-editor\" data-id=\"f727882\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-scinap-sistema-ciberfisico-basado-en-la-inmotica-para-su-aplicacion-en-agricultura-de-precision\/\">SCINAP: Sistema Ciberf\u00edsico basado en la Inm\u00f3tica, para su aplicaci\u00f3n en agricultura de precisi\u00f3n<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li><a href=\"http:\/\/www.domotys.org\/\" target=\"_blank\" rel=\"noopener\">DOMOTYS: Asociaci\u00f3n espa\u00f1ola para el impulso y la innovaci\u00f3n en la dom\u00f3tica, la inm\u00f3tica y las ciudades inteligentes<\/a>.<\/li><li><a href=\"http:\/\/www.setici.net\/\">SET Inform\u00e1tica, Comunicaciones e Ingenier\u00eda S.L<\/a>.<\/li><li><a href=\"http:\/\/www.sinapseenergia.com\/\" target=\"_blank\" rel=\"noopener\">SINAPSE Energ\u00eda, S.L<\/a>.<\/li><li><a href=\"http:\/\/www.nechigroup.com\/index.php\/es\/mamaisys\" target=\"_blank\" rel=\"noopener\">AMAISYS Technologies, S.L<\/a>.<\/li><li><a href=\"http:\/\/www.albufera-energystorage.com\/\" target=\"_blank\" rel=\"noopener\">ALBUFERA Energy Storage, S.L<\/a>.<\/li><li><a href=\"\/descripcion-cenits\/\">C\u00e9nitS<\/a>.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>SCINAP es un proyecto de investigaci\u00f3n industrial basado en la aplicaci\u00f3n de Internet of Things (IOT) y del paradigma de Industria 4.0 en el vector tecnol\u00f3gico de Agricultura de precisi\u00f3n,\u00a0para la generaci\u00f3n de modelos que den respuesta a algunas de las principales cuestiones planteadas en la visi\u00f3n actual de la Pol\u00edtica Agraria Comunitaria en materia de agricultura.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-scinap-sistema-ciberfisico-basado-en-la-inmotica-para-su-aplicacion-en-agricultura-de-precision\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-0d11289 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"0d11289\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-067c1d0 elementor-widget elementor-widget-text-editor\" data-id=\"067c1d0\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-estudio-sobre-la-hemodialisis-progresiva-en-pacientes-incidentes-dippi\/\">Estudio sobre la HemoDi\u00e1lisis Progresiva en Pacientes Incidentes (DiPPI)<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Dr. Javier Deira\u00a0Lorenzo. Servicio de Nefrolog\u00eda del Hospital San Pedro de Alc\u00e1ntara de C\u00e1ceres.<\/li><li>Dr. Miguel \u00c1ngel Suarez Santisteban.\u00a0Servicio de Nefrolog\u00eda del Hospital Virgen del Puerto de Plasencia.<\/li><li>Fundaci\u00f3n para la Formaci\u00f3n e Investigaci\u00f3n de los Profesionales de la Salud de Extremadura\u00a0(<a href=\"http:\/\/www.fundesalud.es\/\" target=\"_blank\" rel=\"noopener\">FundeSalud<\/a>),<\/li><li><a href=\"\/descripcion-cenits\/\">C\u00e9nitS<\/a>.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>El objetivo principal del proyecto es evaluar la utilidad y seguridad de la hemodi\u00e1lisis (HD) progresiva como modalidad de inicio del tratamiento renal sustitutivo (TRS). Para ello se compararan los resultados obtenidos en 76 pacientes que iniciar\u00e1n TRS con una sola sesi\u00f3n por semana (HD progresiva), con otros 76 pacientes que inician TRS con tres veces por semana (HD convencional). Si se corroboran los resultados, se podr\u00e1 mejorar la prescripci\u00f3n de la dosis de HD en los pacientes incidentes, mientras que estos mantienen su funci\u00f3n renal residual (FRR). Ello mejorar\u00eda de forma significativa su calidad de vida, al evitarse un n\u00famero considerable de desplazamientos, junto a un importante ahorro econ\u00f3mico.\u00a0<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-estudio-sobre-la-hemodialisis-progresiva-en-pacientes-incidentes-dippi\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-4474390 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"4474390\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-084faeb elementor-widget elementor-widget-text-editor\" data-id=\"084faeb\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-analisis-y-consultoria-de-proyecto-oncogentic-tecnologias-informaticas-y-de-las-comunicaciones-al-servicio-asistencial-de-especialistas-y-pacientes-de-enfermedades-oncologicas\/\">An\u00e1lisis y Consultor\u00eda de proyecto OncoGenTIC: Tecnolog\u00edas Inform\u00e1ticas y de las Comunicaciones al servicio asistencial de especialistas y pacientes de enfermedades oncol\u00f3gicas<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li><a href=\"\/descripcion-cenits\/\">C\u00e9nitS<\/a>.<\/li><li>CLOUDEX S.L.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>El programa de Innovaci\u00f3n y Talento (PIT), promovido por la Consejer\u00eda de Educaci\u00f3n y Empleo de la Junta de Extremadura, y destinado a la contrataci\u00f3n de desempleados menores de 30 a\u00f1os, combina la formaci\u00f3n de tecn\u00f3logos con las pr\u00e1cticas profesionales en empresas privadas. As\u00ed, su objetivo es facilitar la inserci\u00f3n laboral de j\u00f3venes y potenciar las capacidades del talento de la regi\u00f3n extreme\u00f1a en las siguientes \u00e1reas estrat\u00e9gicas: agroalimentaria, tecnolog\u00edas de la informaci\u00f3n y la comunicaci\u00f3n (TIC), turismo, salud, energ\u00edas limpias, investigaci\u00f3n b\u00e1sica, humanidades y ciencias sociales, econom\u00eda verde, econom\u00eda circular y bioeconom\u00eda.<\/p><\/div><\/div><\/div><\/div><\/header><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-analisis-y-consultoria-de-proyecto-oncogentic-tecnologias-informaticas-y-de-las-comunicaciones-al-servicio-asistencial-de-especialistas-y-pacientes-de-enfermedades-oncologicas\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-6c3af7e e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"6c3af7e\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-5582716 elementor-widget elementor-widget-text-editor\" data-id=\"5582716\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><a href=\"\/analysis-and-consultancy-of-the-oncogentic-project-information-technologies-and-communications-on-the-healthcare-service-of-specialists-and-patients-of-oncological-diseases\/\"><span style=\"font-size: 14pt;\">Analysis and Consultancy of the OncoGenTIC project: Information Technologies and Communications on the healthcare service of specialists and patients of oncological diseases<\/span><\/a><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li><a href=\"\/descripcion-cenits\/\">C\u00e9nitS<\/a>.<\/li><li>CLOUDEX S.L.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>The Innovation and Talent Program (PIT), promoted by the Office of Education and Employment of the Junta of Extremadura, and aimed at hiring unemployed people under 30, combines the training of technologists with professional practices in private companies. Thus, its objective is to facilitate the job placement of young people and to enhance the skills of the Extremadura region&#8217;s talent in the following strategic areas: agro-food, information and communication technologies (ICT), tourism, health, clean energies, basic research, humanities and social sciences, green economy, circular economy and bioeconomy.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/analysis-and-consultancy-of-the-oncogentic-project-information-technologies-and-communications-on-the-healthcare-service-of-specialists-and-patients-of-oncological-diseases\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-fcc55ab e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"fcc55ab\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-1cce2df elementor-widget elementor-widget-text-editor\" data-id=\"1cce2df\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-iotagro-4-0\/\">IoTAgro 4.0<\/a><\/span><\/h2><div class=\"contextual-links-wrapper contextual-links-processed\">\u00a0<\/div><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li><a href=\"\/descripcion-cenits\/\">C\u00e9nitS<\/a>.<\/li><li><a href=\"http:\/\/www.setici.net\/\" target=\"_blank\" rel=\"noopener\">SET S.L<\/a>.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>El programa de Innovaci\u00f3n y Talento (PIT), promovido por la Consejer\u00eda de Educaci\u00f3n y Empleo de la Junta de Extremadura, y destinado a la contrataci\u00f3n de desempleados menores de 30 a\u00f1os, combina la formaci\u00f3n de tecn\u00f3logos con las pr\u00e1cticas profesionales en empresas privadas. As\u00ed, su objetivo es facilitar la inserci\u00f3n laboral de j\u00f3venes y potenciar las capacidades del talento de la regi\u00f3n extreme\u00f1a en las siguientes \u00e1reas estrat\u00e9gicas: agroalimentaria, tecnolog\u00edas de la informaci\u00f3n y la comunicaci\u00f3n (TIC), turismo, salud, energ\u00edas limpias, investigaci\u00f3n b\u00e1sica, humanidades y ciencias sociales, econom\u00eda verde, econom\u00eda circular y bioeconom\u00eda.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-iotagro-4-0\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-56afce6 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"56afce6\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-211c878 elementor-widget elementor-widget-text-editor\" data-id=\"211c878\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-atomistic-simulations-to-investigate-phosphocholine-micelle-self-assembly-and-degradation\/\">Atomistic Simulations to Investigate Phosphocholine Micelle Self-assembly and Degradation<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Christian Lorenz (I.P.).\u00a0<a href=\"https:\/\/www.kcl.ac.uk\/\" target=\"_blank\" rel=\"noopener\">King&#8217;s College London<\/a>.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la\u00a0<a href=\"https:\/\/www.res.es\/\">Red Espa\u00f1ola de Supercomputaci\u00f3n<\/a>.\u00a0<\/p><p>A large number of small molecules currently under development as drug candidates are hydrophobic, and as a result many of these drugs may not make it to market because of problems encountered due to poor water solubility. The therapeutic effects of many drugs already on the market could also be enhanced by developing drug delivery vehicles which increase their solubility. This work is a multiscale analysis of the formation and degradation of self-assembling phospholipid micelles for their potential application in the delivery of these hydrophobic drug molecules by encapsulating them within the hydrophobic core of the micelle and then degrading to release the hydrophobic drugs at the target site.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-atomistic-simulations-to-investigate-phosphocholine-micelle-self-assembly-and-degradation\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-e5bb48b e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"e5bb48b\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-a885a3c elementor-widget elementor-widget-text-editor\" data-id=\"a885a3c\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyectos\/proyecto-ab-initio-simulation-of-the-electronic-and-magnetic-properties-in-iridate-based-oxide-heterostructures\/\">Ab-initio simulation of the electronic and magnetic properties in iridate-based oxide heterostructures<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Juan Ignacio Beltr\u00e1n (I.P.).\u00a0<a href=\"https:\/\/www.ucm.es\/\" target=\"_blank\" rel=\"noopener\">Universidad Complutense de Madrid<\/a>.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la\u00a0<a href=\"https:\/\/www.res.es\/\">Red Espa\u00f1ola de Supercomputaci\u00f3n<\/a>.\u00a0<\/p><p>Oxide heterostructure (OH) with spin-orbit-coupling like SrIrO3\/SrTiO3 have the potential to be designed as topological insulators, either band or Mott types. This roots on the properties exhibited by the iridates family of Ruddlesen-Proper series since the members with n=1,2,\u221e are antiferromagnetic (AFM) Mott insulator, AFM band insulator and paramagnetic semimetal phases respectively. There is a number of works relating the RPS properties and thin film configurations of strain and oxygen vacancies which could provide an atomic engineering path towards topological phases and transitions, however the topic is still at its infancy. This project aims to tackle this issue using simulation techniques efficient of providing an experimentally realistic scenario of the quantum mechanisms such as the octahedral distortion and bandwidth in OH.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyectos\/proyecto-ab-initio-simulation-of-the-electronic-and-magnetic-properties-in-iridate-based-oxide-heterostructures\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t<div class=\"elementor-element elementor-element-6e175fb elementor-widget elementor-widget-text-editor\" data-id=\"6e175fb\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-efect-of-oxygen-vacancies-in-bismut-oxide-energy-loss-near-edge-structure-spectra-by-ab-initio-simulations\/\">Efect of oxygen vacancies in bismut oxide Energy-Loss Near-Edge Structure spectra by ab initio simulations<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Francesca Peir\u00f3 (I.P.),\u00a0Javier Blanco Portals, Sonia Estrade Albiol and Catalina Coll Benejam. (<a href=\"http:\/\/www.ub.edu\/\">Universitat de Barcelona<\/a>).<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la\u00a0<a href=\"https:\/\/www.res.es\/\">Red Espa\u00f1ola de Supercomputaci\u00f3n<\/a>.\u00a0<\/p><p>The present work summarizes the results of combining experimental Electron Energy Loss Spectroscopy measurements and Density Funtion Theory (DFT) simulations to detect and quantify oxygen vacancies in bismut oxide nanowires. The combination of experimental results and ab initio calculations give the possibility of understanding the optoelectronic properties of the sample and, since, one can control the percentage and the position of oxygen vacancies, it allows to analyze their effect. The theoretical calculations of the electronic structure were carried out using the linearized augmented plane wave (LAPW) method based on DFT, implemented on WIEN2k ab initio simulation package.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-efect-of-oxygen-vacancies-in-bismut-oxide-energy-loss-near-edge-structure-spectra-by-ab-initio-simulations\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-e0d287a e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"e0d287a\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-1823aac elementor-widget elementor-widget-text-editor\" data-id=\"1823aac\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-grupo-operativo-gapter-ganaderia-de-precision-para-terneros-sostenibilidad-y-bienestar-animal\/\">Grupo Operativo GAPTER (Ganader\u00eda de precisi\u00f3n para terneros, sostenibilidad y bienestar animal)<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Copreca, Set Inform\u00e1tica, Comunicaciones, e Ingenier\u00eda, ADEVICE, CICYTEX (Centro de Investigaciones Cient\u00edficas y Tecnol\u00f3gicas de Extremadura), Universidad de Sevilla Escuela T\u00e9cnica Superior de Ingenier\u00eda (Telecomunicaciones) y Fundaci\u00f3n COMPUTAEX.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Este grupo operativo se centra en la aplicaci\u00f3n los sistemas PLF (Precision Livestock Farming) para la consecuci\u00f3n de modelos de bienestar animal, a partir de la monitorizaci\u00f3n, en tiempo real, del comportamiento y respuesta de los animales, frente a nuevas formulaciones alimenticias y nutricionales que reducen la huella de carbono y el impacto ambiental de las explotaciones bobinas de car\u00e1cter intensivo.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-grupo-operativo-gapter-ganaderia-de-precision-para-terneros-sostenibilidad-y-bienestar-animal\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-4fcaee8 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"4fcaee8\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-25703a5 elementor-widget elementor-widget-text-editor\" data-id=\"25703a5\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-grupo-operativo-apmef-agricultura-de-precision-aplicada-para-la-mejora-de-explotaciones-frutales\/\">Grupo operativo APMEF (Agricultura de precisi\u00f3n aplicada para la mejora de explotaciones frutales).<\/a><\/span><\/h2><div class=\"contextual-links-wrapper contextual-links-processed\"><strong>Investigadores:\u00a0<\/strong><\/div><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Grupo Fruvaygo Machuca, Set Inform\u00e1tica, Comunicaciones, e Ingenier\u00eda, ADEVICE, Cellnex Telecom, Agrodrone, Tepro Consultores Agr\u00edcolas, CICYTEX (Centro de Investigaciones Cient\u00edficas y Tecnol\u00f3gicas de Extremadura), Universidad de Sevilla Escuela T\u00e9cnica Superior de Ingenier\u00eda (Telecomunicaciones) y Fundaci\u00f3n COMPUTAEX.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Este grupo operativo tiene como objetivo la mejora y optimizaci\u00f3n de las explotaciones de frutales, mediante la aplicaci\u00f3n de la agricultura de precisi\u00f3n, orientado a la aplicaci\u00f3n de nuevas tecnolog\u00edas en el manejo de nutrientes, del suelo y del cultivo para la consecuci\u00f3n de nuevos modelos eficientes y sostenibles de producci\u00f3n de frutales.<\/p><\/div><\/div><\/div><\/div><h2 class=\"title\"><span style=\"color: #777777; font-family: 'Open Sans', Helvetica, Arial, sans-serif; font-size: 13px;\">.\u00a0<\/span><\/h2><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-grupo-operativo-apmef-agricultura-de-precision-aplicada-para-la-mejora-de-explotaciones-frutales\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-3c25a7b e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"3c25a7b\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-86b1de4 elementor-widget elementor-widget-text-editor\" data-id=\"86b1de4\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-sciot-sistemas-ciberfisicos-enmarcados-en-iot-para-aplicacion-en-ganaderia-de-precision\/\">SCIoT: Sistemas Ciberf\u00edsicos enmarcados en IoT para aplicaci\u00f3n en ganader\u00eda de precisi\u00f3n<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Set Inform\u00e1tica, Comunicaciones, e Ingenier\u00eda y Fundaci\u00f3n COMPUTAEX.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>El objetivo principal de este proyecto se centra en la aplicaci\u00f3n de los sistemas PLF (Precision Livestock Farming) para la consecuci\u00f3n de modelos de bienestar animal, a partir de la investigaci\u00f3n de nuevos sistemas ciberf\u00edsicos basados en el concepto de Internet de las Cosas (IoT) destinados a la monitorizaci\u00f3n, en tiempo real, del comportamiento y respuesta de los animales, en las explotaciones bovinas de car\u00e1cter intensivo.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-sciot-sistemas-ciberfisicos-enmarcados-en-iot-para-aplicacion-en-ganaderia-de-precision\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-d246e73 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"d246e73\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-fd4af62 elementor-widget elementor-widget-text-editor\" data-id=\"fd4af62\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><span style=\"font-size: 14pt; color: #000000;\"><a style=\"font-family: Raleway, Helvetica, Arial, sans-serif; font-weight: 600; color: #000000;\" href=\"\/rumimeta-decrease-in-the-methane-footprint-by-inclusion-of-wine-making-polyphenols-in-ruminant-feed-monitoring-of-its-effect-on-the-welfare-of-animals-during-calf-fattening\/\">RUMIMETA: Decrease in the methane footprint by inclusion of wine-making polyphenols in ruminant feed. Monitoring of its effect on the welfare of animals during calf fattening.<\/a><\/span><\/div><\/div><\/div><\/div><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>COPRECA SDAD. COOP. (coordinator), Set Inform\u00e1tica, Comunicaciones, and Ingenier\u00eda S.L., Heral Enolog\u00eda S.L, CICYTEX (Center for Scientific and Technological Research of Extremadura), University of Extremadura and the COMPUTAEX Foundation.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>The general objective of the project is to determine the effects produced in ruminant animals, both in terms of their influence on the methane footprint, and in the repercussions on meat quality, animal welfare and production costs, due to the incorporation of polyphenols in their diets.<\/p><p>The RUMIMETA project focuses on the consideration that animal production is an important source of greenhouse gas (GHG) emissions throughout the world. Depending on the approach used for the quantification and the type of emissions studied, different institutions (IPCC, FAO, EPA and others) have calculated that the contribution of livestock to global emissions of anthropogenic GHGs represent between 7 and 18 percent of the total emissions.<\/p><p>From these works it has been possible to evaluate the potential of practices related to nutrition, the generation of manure and animal husbandry in the reduction of methane and nitrous oxide, that is, in GHG emissions other than carbon dioxide, in animal production.<\/p><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/rumimeta-decrease-in-the-methane-footprint-by-inclusion-of-wine-making-polyphenols-in-ruminant-feed-monitoring-of-its-effect-on-the-welfare-of-animals-during-calf-fattening\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-97b5caf e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"97b5caf\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-54c160c elementor-widget elementor-widget-text-editor\" data-id=\"54c160c\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-rumimeta-disminucion-de-la-huella-de-metano-por-inclusion-de-polifenoles-vitivinicolas-en-la-alimentacion-de-rumiantes-monitorizacion-de-su-efecto-en-el-bienestar-de-los-animales-durante-e\/\">RUMIMETA: Disminuci\u00f3n de la huella de metano por inclusi\u00f3n de polifenoles vitivin\u00edcolas en la alimentaci\u00f3n de rumiantes. Monitorizaci\u00f3n de su efecto en el bienestar de los animales durante el cebo de terneros.<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>COPRECA SDAD. COOP. (coordinador), Set Inform\u00e1tica, Comunicaciones, e Ingenier\u00eda S.L., Heral Enolog\u00eda S.L, CICYTEX (Centro de Investigaciones Cient\u00edficas y Tecnol\u00f3gicas de Extremadura), Universidad de Extremadura y Fundaci\u00f3n COMPUTAEX.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>El objetivo general del proyecto es determinar los efectos producidos en animales rumiantes, tanto a nivel de su influencia en la huella de metano, como en las repercusiones en la calidad de la carne, bienestar animal y costes de producci\u00f3n, debido a la incorporaci\u00f3n de polifenoles en las dietas de los mismos.<\/p><p>El enfoque del proyecto RUMIMETA, centra su atenci\u00f3n en la consideraci\u00f3n de que la producci\u00f3n animal es una fuente importante de emisi\u00f3n de gases de efecto invernadero (GEI) en todo el mundo. Dependiendo del enfoque utilizado para la cuantificaci\u00f3n y del tipo de\u00a0emisiones estudiadas, diferentes instituciones (IPCC, FAO, EPA y otras) han calculado que la contribuci\u00f3n del ganado a las emisiones mundiales de los GEI antrapog\u00e9nico representan entre el 7 y el 18 por ciento de las emisiones totales.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-rumimeta-disminucion-de-la-huella-de-metano-por-inclusion-de-polifenoles-vitivinicolas-en-la-alimentacion-de-rumiantes-monitorizacion-de-su-efecto-en-el-bienestar-de-los-animales-durante-e\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-2a45bb4 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"2a45bb4\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-e50ad74 elementor-widget elementor-widget-text-editor\" data-id=\"e50ad74\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/heritagen-next-generation-sequencing-and-supercomputing-for-the-unification-of-the-genealogical-and-genetic-heritage-of-extremadura-application-to-the-study-of-hereditary-diseases\/\">HERITAGEN: Next-Generation Sequencing and supercomputing for the unification of the genealogical and genetic heritage of Extremadura. Application to the study of hereditary diseases.<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Jos\u00e9 Luis Gonz\u00e1lez S\u00e1nchez (Principal Investigator). COMPUTAEX Foundation.<\/li><li>Silvia Romero Chala. San Pedro de Alc\u00e1ntara Hospital.<\/li><li>Jonathan G\u00f3mez Raja. FUNDESALUD (Foundation for Research and Training of Health Professionals of Extremadura).<\/li><li>Jos\u00e9 Antonio Garc\u00eda Trujillo. San Pedro de Alc\u00e1ntara Hospital.<\/li><li>Felipe Lemus Prieto. COMPUTAEX Foundation.<\/li><li>Alfonso L\u00f3pez Rourich. COMPUTAEX Foundation.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>It is estimated that approximately 1 in 200 births can be affected by the 6,000 known monogenic diseases. Establishing the pathogenicity of the mutations detected by means of NextGeneration Sequencing in the sequence of the genes involved will be of vital importance for the development of therapies in order to develop the Precision Medicine concept.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/heritagen-next-generation-sequencing-and-supercomputing-for-the-unification-of-the-genealogical-and-genetic-heritage-of-extremadura-application-to-the-study-of-hereditary-diseases\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-ae66bcc e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"ae66bcc\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-fb0bf6a elementor-widget elementor-widget-text-editor\" data-id=\"fb0bf6a\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-heritagen-ultrasecuenciacion-y-supercomputacion-para-la-unificacion-del-patrimonio-genealogico-y-genetico-extremeno-aplicacion-al-estudio-de-enfermedades-hereditarias\/\">HeritaGen: Ultrasecuenciaci\u00f3n y supercomputaci\u00f3n para la unificaci\u00f3n del patrimonio geneal\u00f3gico y gen\u00e9tico extreme\u00f1o. Aplicaci\u00f3n al estudio de enfermedades hereditarias.<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Jos\u00e9 Luis Gonz\u00e1lez S\u00e1nchez (Investigador principal). Fundaci\u00f3n COMPUTAEX.<\/li><li>Silvia Romero Chala. Hospital San Pedro de Alc\u00e1ntara.<\/li><li>Jonathan G\u00f3mez Raja. Fundesalud.<\/li><li>Jos\u00e9 Antonio Garc\u00eda Trujillo. Hospital San Pedro de Alc\u00e1ntara.<\/li><li>Felipe Lemus Prieto. Fundaci\u00f3n COMPUTAEX.<\/li><li>Alfonso L\u00f3pez Rourich. Fundaci\u00f3n COMPUTAEX.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Se estima que aproximadamente 1 de cada 200 nacimientos pueden verse afectados por las 6.000 enfermedades monog\u00e9nicas conocidas. Establecer la patogenicidad de las mutaciones detectadas mediante t\u00e9cnicas de secuenciaci\u00f3n masiva o ultrasecuenciaci\u00f3n (NGS, NextGeneration Sequencing) en la secuencia de los genes implicados ser\u00e1 de vital importancia para el desarrollo de terapias enmarcadas en el concepto Precision Medicine.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-heritagen-ultrasecuenciacion-y-supercomputacion-para-la-unificacion-del-patrimonio-genealogico-y-genetico-extremeno-aplicacion-al-estudio-de-enfermedades-hereditarias\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-3d1098c e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"3d1098c\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-54e4a3c elementor-widget elementor-widget-text-editor\" data-id=\"54e4a3c\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><a style=\"font-family: Raleway, Helvetica, Arial, sans-serif; font-size: 1.5625rem; font-weight: 600;\" href=\"\/proyecto-flow-instabilities-in-two-component-2d-bose-einstein-condensates\/\"><span style=\"font-size: 14pt; color: #000000;\">Flow instabilities in two-component 2D Bose-Einstein condensates\u00a0<\/span><\/a><\/div><\/div><\/div><\/div><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Investigador principal:\u00a0Antonio Mu\u00f1oz Mateo.\u00a0<a href=\"http:\/\/www.ub.edu\/\">Universidad de Barcelona<\/a>.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la\u00a0<a href=\"https:\/\/www.res.es\/\">Red Espa\u00f1ola de Supercomputaci\u00f3n<\/a>.\u00a0<\/p><p>Study of the generation and evolution of nonlinear excitations in two-component (pseudo-spin 1\/2) 2D Bose-Einstein condensates of ultracold atomic gases. The project will be focused on the onset of the instabilities in stationary states that give place to the appearance of vortices and solitons.<br \/>\u00a0<br \/>The equations of motion of the coupled superfluids, in a mean field approximation, will be numerically solved by means of a massively parallel Trotter-Suzuki-MPI solver, with all computational details made available to the public to ensure easy reproduceability of the results.<\/p><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-flow-instabilities-in-two-component-2d-bose-einstein-condensates\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-5bdc0b0 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"5bdc0b0\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-6f30af6 elementor-widget elementor-widget-text-editor\" data-id=\"6f30af6\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyectos\/proyecto-ab-initio-molecular-dynamics-of-photovoltaic-organic-self-assembled-monolayers-adsorbed-on-metal-surfaces\/\">Ab initio molecular dynamics of photovoltaic organic self-assembled monolayers adsorbed on metal surfaces<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Investigador principal:\u00a0Sergio Diaz Tendero.\u00a0<a href=\"https:\/\/www.uam.es\/\">Universidad Aut\u00f3noma de Madrid<\/a>.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la\u00a0<a href=\"https:\/\/www.res.es\/\">Red Espa\u00f1ola de Supercomputaci\u00f3n<\/a>.\u00a0<\/p><p>Study of different properties of small carbon clusters, fullerenes, metal clusters and biomolecules. The main purpose is to understand the mechanism behind the collisions of these species with highly charged atomic ions and energetic photons.<br \/>In carbon clusters, the project is focused on properties such as the electronic structure, geometrical properties and stability. For that it uses usual quantum chemistry methods (coupled cluster and multireference methods) as well as Density Functional Theory (DFT).<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyectos\/proyecto-ab-initio-molecular-dynamics-of-photovoltaic-organic-self-assembled-monolayers-adsorbed-on-metal-surfaces\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-acfe188 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"acfe188\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-dc0eddb elementor-widget elementor-widget-text-editor\" data-id=\"dc0eddb\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-mechanisms-of-molecular-motion-in-polymers-with-nonuniform-stiffness\/\">Mechanisms of Molecular Motion in Polymers with Nonuniform Stiffness<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Jorge Ram\u00edrez Garc\u00eda.\u00a0<a href=\"http:\/\/www.upm.es\/\">Universidad Polit\u00e9cnica de Madrid<\/a>.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Proyecto asignado a trav\u00e9s de la\u00a0<a href=\"https:\/\/www.res.es\/\">Red Espa\u00f1ola de Supercomputaci\u00f3n<\/a>.\u00a0<\/p><p>Our understanding of the dynamics of flexible (Gaussian coil) polymer systems is relatively well developed. However, other advanced applications of polymers such as organic electronics and biomaterials usually combine flexible polymers with a diversity of semi-rigid and rigid polymer structures. In comparison with flexible polymers, extremely little is known about the dynamics of rigid macromolecules [1-2]. Many of these novel semiconducting and bio-functional polymers have very rigid chain topologies due to the presence of PI-conjugated orbitals or strong hydrogen bonded structures. The incorporation of these functionalities into polymers leads to macromolecules that contain both stiff, rod-like regions and flexible, Gaussian coil-like regions.\u00a0 Some examples of these type of novel materials include PEGylated proteins, block copolymer for LEDs and photovoltaics, drug delivery micelles, and hydrogels for tissue engineering. Understanding the processing, mechanics, and kinetics of self-assembly in these materials demands a fundamental understanding of the mechanisms of molecular motion in these hybrid rigid-flexible systems. Recent studies have focused mostly on the synthesis and thermodynamics of these materials.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-mechanisms-of-molecular-motion-in-polymers-with-nonuniform-stiffness\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-f5daa99 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"f5daa99\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-d7c05db elementor-widget elementor-widget-text-editor\" data-id=\"d7c05db\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-electronic-and-thermoelectric-properties-of-doped-cu3sbse4-based-compounds-from-first-principles\/\">Electronic and Thermoelectric Properties of doped-Cu3SbSe4 based compounds from First Principles<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Investigador principal: Pablo Palacios Clemente.\u00a0<a href=\"http:\/\/www.upm.es\/\">Universidad Polit\u00e9cnica de Madrid<\/a>. Departamento de\u00a0F\u00edsica Aplicada a las Tecnolog\u00edas Aeron\u00e1utica y Naval.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Objetivos:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Thermoelectric (TE) materials, which can directly convert hear into electricity or viceversa are attracting much attention due to their potential applications not only in the energy conversion industry but also in providing power for electronics. The performance of a TE material is usually evaluated through the dimensionless figure of merit (ZT): ZT = (S**2aT)\/k (1) where S is the Seebeck coefficient, a is the electrical conductivity, T is the absolute temperature, k is the thermal conductivity and S2a is the so-called power factor (PF). The thermal conductivity k is defined as: k=ke+kl (2) where ke and kl represent the electronic and the lattice components of the thermal conductivity, respectively. Nowadays, only those materials with ZT values amounting to around 1.0 or above are considered to be efficient TE materials. The most efficient way to improve TE performance should increase the Seebeck coefficient and the electrical conductivity (i.e., the power factor should be maximized), while the thermal conductivity k should be minimized. However, these properties are strongly coupled. As matter of fact, the increase in electrical conductivity by increasing carrier concentration results in lower Seebeck coefficient. These problems are appealing the use of theoretical methods for exploring TE materials with improve performance. Among copper based chalcogenide semiconductors, Cu3SbSe4 shows excellent electrical transport properties and relatively low thermal conductivity. Near of the bandgap region, the valence band is mainly due to the hybridization between Cu-3d and Se-4p states, while the conduction band is formed by the hybridization between Sb-5s and Se-4p states. In this configuration, the Cu-Se bonds network plays as the hole conduction path. Therefore, the substitution of Sb atoms could be a reasonable strategy to fine tune the TE properties by adjusting the carrier concentration and minimizing the adverse effects on the hole mobility.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-electronic-and-thermoelectric-properties-of-doped-cu3sbse4-based-compounds-from-first-principles\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-268f38a e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"268f38a\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-759deb1 elementor-widget elementor-widget-text-editor\" data-id=\"759deb1\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\">\u00a0<\/div><\/div><\/div><\/div><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-simulaciones-moleculares-de-docking-acoplamiento-molecular-para-buscar-potenciales-inhibidores-de-diferentes-virus\/\">Simulaciones moleculares de docking (acoplamiento molecular) para buscar potenciales inhibidores de diferentes virus<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Vicente Galiano (IP), Jos\u00e9 Villala\u00edn,\u00a0Emmanuel Fajardo. Departamento de F\u00edsica y Arquitectura de Computadores. Universidad Miguel Hern\u00e1ndez de Elche.\u00a0<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Entre los pat\u00f3genos que causan las mayores tasas de mortalidad y morbilidad en los\u00a0seres humanos y los animales podemos nombrar los virus. Sin embargo, en la gran\u00a0mayor\u00eda de los casos, no hay vacunas o tratamientos terap\u00e9uticos eficaces. A la familia\u00a0Flaviviridae de virus pertenecen una serie de pat\u00f3genos humanos de gran relevancia\u00a0m\u00e9dica. Virus como el virus de la hepatitis C, el virus de la fiebre amarilla, el virus\u00a0West Nile, el virus de la encefalitis transmitida por garrapatas, el zika y el dengue\u00a0pertenecen a esta familia. El dengue (DENV), as\u00ed como el zika (ZIKV), causan las\u00a0enfermedades virales transmitidas por artr\u00f3podos m\u00e1s frecuentes entre los seres\u00a0humanos, afectando a millones de personas al a\u00f1o. Estas enfermedades han\u00a0evolucionado en los \u00faltimos tiempos desde una ocurrencia espor\u00e1dica a un gran\u00a0problema de salud p\u00fablica de orden mundial. Es significativo que todos los procesos\u00a0inherentes al ciclo de replicaci\u00f3n viral est\u00e1n directa o indirectamente relacionados con\u00a0sistemas de membrana o membranas derivadas de ellas. Todo aquello que pueda\u00a0interferir con cualquiera de estos procesos ser\u00eda potencialmente \u00fatil para que el virus o\u00a0bien no puede entrar o bien no pueda salir de la c\u00e9lula. Nuestro grupo tiene como\u00a0objetivo estudiar la estructura y la interacci\u00f3n con diferentes tipos de sistemas modelo\u00a0de biomembrana de varios dominios de p\u00e9ptidos derivados de las prote\u00ednas estructurales\u00a0y no estructurales de los virus DENV y ZIKV. A partir del conocimiento experimental\u00a0que tenemos sobre las prote\u00ednas estructurales y no estructurales del DENV, nuestros\u00a0objetivos son el estudio in silico de la din\u00e1mica molecular de los p\u00e9ptidos seleccionados\u00a0de DENV y ZIKV interactuantes con sistemas modelo de \u00a0iomembranas, la obtenci\u00f3n\u00a0de informaci\u00f3n exhaustiva sobre su estructura y su interacci\u00f3n espec\u00edfica con los\u00a0l\u00edpidos, la determinaci\u00f3n mediante in silico screening y peptide docking con el fin de\u00a0obtener p\u00e9ptidos antivirales y mol\u00e9culas bioactivas contra aquellas estructuras obtenidas\u00a0anteriormente, y en su caso probarlas in vitro para comprobar su efectividad utilizando\u00a0diferentes composiciones de biomembranas modelo. Todo esto permitir\u00e1 el desarrollo\u00a0de nuevos compuestos \u00fatiles para la mejora de las terapias combinadas con el fin de\u00a0lograr el objetivo final, la erradicaci\u00f3n de las infecciones virales producidas por DENV\u00a0y ZIKV.<\/p><p>\u00a0<\/p><div align=\"center\"><img decoding=\"async\" class=\"aligncenter\" src=\"https:\/\/www.computaex.es\/sites\/cenits.es\/files\/noticias\/docked_compound_to_dennv_rdrp.png\" alt=\"\" \/><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-simulaciones-moleculares-de-docking-acoplamiento-molecular-para-buscar-potenciales-inhibidores-de-diferentes-virus\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-be0cea0 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"be0cea0\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-79e6a96 elementor-widget elementor-widget-text-editor\" data-id=\"79e6a96\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyectos\/proyecto-activacion-molecular-mediante-complejos-organometalicos-con-enlaces-multiples-heterometalicos\/\">Activaci\u00f3n molecular mediante complejos organomet\u00e1licos con enlaces m\u00faltiples heteromet\u00e1licos<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Miguel Angel Ruiz Alvarez (IP), Daniel Garc\u00eda-Viv\u00f3, M\u00aa Esther Garc\u00eda D\u00edaz, M\u00aa Angeles Alvarez Fidalgo. Area de Qu\u00edmica Inorg\u00e1nica, Universidad de Oviedo.<\/p><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>El objetivo general de la presente investigaci\u00f3n es sintetizar nuevos complejos con enlaces m\u00faltiples heteromet\u00e1licos y estudiar su reactividad en un sentido amplio, poniendo especial atenci\u00f3n en los procesos generales de activaci\u00f3n de mol\u00e9culas sencillas y su posible utilidad en campos m\u00e1s aplicados como la cat\u00e1lisis. Se parte de la hip\u00f3tesis, contrastada en distintos estudios experimentales previos, de que los compuestos con enlaces m\u00faltiples heteromet\u00e1licos pueden mostrar una reactividad superior a la de sus hom\u00f3logos homomet\u00e1licos, debido a la polaridad intr\u00ednseca del enlace heteronuclear. En particular, y aprovechando la gran experiencia del grupo investigador en el \u00e1rea de los compuestos carbon\u00edlicos homobinucleares de los elementos de transici\u00f3n, se abordar\u00e1 la s\u00edntesis de nuevos compuestos carbon\u00edlicos y ciclopentadien\u00edlicos con enlaces m\u00faltiples entre \u00e1tomos met\u00e1licos diferentes, principalmente de los grupos 6 a 8, estabilizados mediante ligandos puente de tipo fosfuro (PR2) o fosfinideno (PR), que adicionalmente pueden contener, o no, ligandos hidruro puente. En una fase posterior se estudiar\u00e1 la reactividad general de estos complejos frente a mol\u00e9culas org\u00e1nicas e inorg\u00e1nicas sencillas, y frente a otros complejos met\u00e1licos, y tambi\u00e9n se analizar\u00e1 su actividad en relaci\u00f3n con algunos procesos de inter\u00e9s m\u00e1s aplicado, tales como procesos de hidrogenaci\u00f3n, activaci\u00f3n de \u00f3xidos de nitr\u00f3geno y del f\u00f3sforo elemental.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyectos\/proyecto-activacion-molecular-mediante-complejos-organometalicos-con-enlaces-multiples-heterometalicos\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-6d71043 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"6d71043\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-6c2a731 elementor-widget elementor-widget-text-editor\" data-id=\"6c2a731\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\">\u00a0<\/div><\/div><\/div><\/div><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-flow-induced-anisotropy-in-metallic-glasses\/\">Flow-induced anisotropy in metallic glasses<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Daniel Crespo.\u00a0Departamento de F\u00edsica,\u00a0<a href=\"http:\/\/www.upc.edu\/\" target=\"_blank\" rel=\"noopener\">Universidad Polit\u00e9cnica de Catalunya<\/a>.<\/li><li>Eloi Pineda.\u00a0Departamento de F\u00edsica,\u00a0<a href=\"http:\/\/www.upc.edu\/\" target=\"_blank\" rel=\"noopener\">Universidad Polit\u00e9cnica de Catalunya<\/a>.<\/li><li>Jorge E. Velasco.\u00a0Departamento de F\u00edsica,\u00a0<a href=\"http:\/\/www.upc.edu\/\" target=\"_blank\" rel=\"noopener\">Universidad Polit\u00e9cnica de Catalunya<\/a>.<\/li><li>Amadeu Concustell.\u00a0Centro de proyecci\u00f3n t\u00e9rmica,\u00a0<a href=\"http:\/\/www.ub.edu\/\" target=\"_blank\" rel=\"noopener\">Universidad de Barcelona<\/a><\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Se denominan vidrios met\u00e1licos a los materiales amorfos compuestos mayoritariamente por elementos met\u00e1licos. Los vidrios met\u00e1licos fueron descubiertos en 1960, y desde entonces han sido objeto de gran inter\u00e9s cient\u00edfico a causa de sus peculiares propiedades. La falta de estructura cristalina permite obtener materiales con resistencia mec\u00e1nica superior a aleaciones cristalinas de composici\u00f3n similar, y tambi\u00e9n se han obtenidos excelentes aleaciones magn\u00e9ticas blandas, que se utilizan en transformadores de muy bajas perdidas.<\/p><p>Los vidrios met\u00e1licos se producen por enfriamiento r\u00e1pido, de forma similar a los vidrios tradicionales basados en \u00f3xido de Silicio. Durante el enfriamiento la viscosidad del l\u00edquido aumenta varios ordenes de magnitud, y cuando la viscosidad supera un valor cr\u00edtico el l\u00edquido sobreenfriado queda cinem\u00e1ticamente \u201ccongelado\u201d. Es decir, el material conserva la estructura at\u00f3mica del l\u00edquido del que procede. Este proceso se conoce como transici\u00f3n v\u00edtrea, y es uno de los problemas abiertos en la investigaci\u00f3n de la f\u00edsica de materiales. Se trata de un problema complejo de mec\u00e1nica estad\u00edstica no estacionaria, y por este motivo la simulaci\u00f3n num\u00e9rica mediante Din\u00e1mica Molecular es una t\u00e9cnica muy valiosa en su estudio, complementando la informaci\u00f3n experimental.<\/p><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-flow-induced-anisotropy-in-metallic-glasses\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-091ed72 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"091ed72\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-21ef290 elementor-widget elementor-widget-text-editor\" data-id=\"21ef290\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-ultrasecuenciacion-genetica-mediante-tecnicas-de-supercomputacion\/\">Ultrasecuenciaci\u00f3n gen\u00e9tica mediante t\u00e9cnicas de supercomputaci\u00f3n<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li><a href=\"http:\/\/www.areasaludcaceres.es\/modulos\/mod_organigrama\/pub\/ficha_servicios.php?id=4\">Servicio de Inmunolog\u00eda y Gen\u00e9tica Molecular del Hospital San Pedro de Alc\u00e1ntara de C\u00e1ceres<\/a>\u00a0y\u00a0<a href=\"\/descripcion-la-fundacion\/\">Fundaci\u00f3n COMPUTAEX<\/a><\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Este proyecto, asistencial y de investigaci\u00f3n, est\u00e1 siendo desarrollado por el\u00a0<a href=\"http:\/\/www.areasaludcaceres.es\/modulos\/mod_organigrama\/pub\/ficha_servicios.php?id=4\">Servicio de Inmunolog\u00eda y Gen\u00e9tica Molecular del Hospital San Pedro de Alc\u00e1ntara de C\u00e1ceres<\/a>\u00a0(Servicio Extreme\u00f1o de Salud) en colaboraci\u00f3n con investigadores de la\u00a0<a href=\"\/descripcion-la-fundacion\/\">Fundaci\u00f3n COMPUTAEX<\/a>. Las nuevas t\u00e9cnicas de secuenciaci\u00f3n masiva de ADN, cuyo uso se est\u00e1 imponiendo en el \u00e1mbito de la gen\u00e9tica y la bioinform\u00e1tica, permiten secuenciar el genoma de un ser humano con una reducci\u00f3n en t\u00e9rminos de tiempo y coste econ\u00f3mico cada vez mayor. Por ello, se hace necesaria la utilizaci\u00f3n de supercomputadores como\u00a0<a href=\"\/lusitania\/\">LUSITANIA<\/a>, que adem\u00e1s de procesar la ingente cantidad de datos generada, para poder estudiar la informaci\u00f3n contenida en el ADN, permite simular rasgos complejos de genes, estructuras subat\u00f3micas y tridimensionales, as\u00ed como amino\u00e1cidos de las prote\u00ednas.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-ultrasecuenciacion-genetica-mediante-tecnicas-de-supercomputacion\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-1246d61 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"1246d61\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-72086ed elementor-widget elementor-widget-text-editor\" data-id=\"72086ed\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-efectos-estereoelectronicos-y-del-disolvente-en-las-conformaciones-de-heterociclos-saturados-de-5-y-6-miembros\/\">Efectos estereoelectr\u00f3nicos y del disolvente en las conformaciones de heterociclos saturados de 5 y 6 miembros<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li><strong>Juan Manuel Garrido<\/strong>,\u00a0<a href=\"http:\/\/www.unex.es\/\">Universidad de Extremadura<\/a><\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Algunos derivados de las 2-amino-2-desoxialdosas se presentan mayoritariamente bajo la forma anom\u00e9rica \u03b1 (hidroxilo anom\u00e9rico axial), lo cual tiene f\u00e1cil explicaci\u00f3n invocando el efecto anom\u00e9rico que favorecer\u00eda el predominio de compuestos con el hidroxilo anom\u00e9rico axial frente a las disposiciones ecuatoriales que los motivos est\u00e9ricos deber\u00edan favorecer.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-efectos-estereoelectronicos-y-del-disolvente-en-las-conformaciones-de-heterociclos-saturados-de-5-y-6-miembros\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-37a2710 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"37a2710\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-4c80310 elementor-widget elementor-widget-text-editor\" data-id=\"4c80310\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-analisis-clinico-inmunologico-y-genetico-del-deficit-selectivo-de-iga-estudio-longitudinal-de-los-pacientes-acumulados-en-un-centro-de-referencia-durante-los-ultimos-18-anos\/\">An\u00e1lisis cl\u00ednico, inmunol\u00f3gico y gen\u00e9tico del d\u00e9ficit selectivo de IGA. Estudio longitudinal de los pacientes acumulados en un centro de referencia durante los \u00faltimos 18 a\u00f1os<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li><a href=\"http:\/\/fundesalud.es\/web\/inicio\">Fundesalud<\/a>,\u00a0<a href=\"http:\/\/www.areasaludcaceres.es\/modulos\/mod_organigrama\/pub\/ficha_centros.php?id=148\">Hospital San Pedro de Alc\u00e1ntara<\/a>,\u00a0<a href=\"http:\/\/www.unex.es\/\">Universidad de Extremadura<\/a>\u00a0y\u00a0<a href=\"\/descripcion-cenits\/\">C\u00e9nitS<\/a><\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>El d\u00e9ficit selectivo de IgA es la inmunodeficiencia primaria m\u00e1s frecuente en nuestro medio. Su etiopatogenia es muy compleja y poco comprendida. Aunque presenta agregaci\u00f3n familiar un un modelo de herencia mendeliano, sus causas gen\u00e9ticas todav\u00eda no se han encontrado. Hasta la fecha no se han utilizado plataformas de secuenciaci\u00f3n masiva que analicen el exoma completo o arrays de CGH de alta resoluci\u00f3n (de 1 mill\u00f3n de sondas) para el estudio de las variantes en el n\u00famero de copias gen\u00e9ticas. La hip\u00f3tesis residi\u00f3 en que estos an\u00e1lisis podr\u00edan desentra\u00f1ar las alteraciones gen\u00e9ticas implicadas en la enfermedad.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-analisis-clinico-inmunologico-y-genetico-del-deficit-selectivo-de-iga-estudio-longitudinal-de-los-pacientes-acumulados-en-un-centro-de-referencia-durante-los-ultimos-18-anos\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-c4a5927 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"c4a5927\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-3b1e399 elementor-widget elementor-widget-text-editor\" data-id=\"3b1e399\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-estudio-computacional-de-la-reactividad-de-los-compuestos-organicos\/\">Estudio computacional de la reactividad de los compuestos org\u00e1nicos<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li><strong>Pedro Cintas Moreno, Mart\u00edn \u00c1valos Gonz\u00e1lez, Reyes Babiano Caballero, David Cantillo Nieves, Jos\u00e9 Luis Jim\u00e9nez Requejo, Rafael Fernando Mart\u00ednez V\u00e1zquez, Juan Carlos Palacios Albarr\u00e1n y\u00a0Esther Matamoros Castellano<\/strong>.\u00a0<a href=\"http:\/\/www.unex.es\/investigacion\/grupos\/quorex\">Grupo QUOREX<\/a>.\u00a0<a href=\"http:\/\/www.unex.es\/\">Universidad de Extremadura<\/a>.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>El grupo de investigaci\u00f3n\u00a0<a href=\"http:\/\/www.unex.es\/investigacion\/grupos\/quorex\">QUOREX<\/a>\u00a0de Qu\u00edmica Org\u00e1nica, catalogado tanto en la\u00a0<a href=\"http:\/\/www.unex.es\/\">Universidad de Extremadura<\/a>\u00a0como en la Junta de Extremadura (FQM-007), est\u00e1 integrado por docentes e investigadores cuyas l\u00edneas de trabajo se encuentran financiadas a trav\u00e9s de proyectos nacionales (Ministerio de Ciencia e Innovaci\u00f3n) y regionales (Consejer\u00eda de Econom\u00eda, Comercio e Innovaci\u00f3n).<\/p><\/div><\/div><\/div><\/div><h2 class=\"title\"><span style=\"color: #777777; font-family: 'Open Sans', Helvetica, Arial, sans-serif; font-size: 13px;\">.\u00a0<\/span><\/h2><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-estudio-computacional-de-la-reactividad-de-los-compuestos-organicos\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-f96f601 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"f96f601\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-3bfc52c elementor-widget elementor-widget-text-editor\" data-id=\"3bfc52c\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-estirpex-2\/\">Estirpex-2<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li><a href=\"\/descripcion-cenits\/\" target=\"_blank\" rel=\"noopener\">C\u00e9nitS<\/a><\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p class=\"rtecenter\"><img fetchpriority=\"high\" decoding=\"async\" class=\"aligncenter\" src=\"https:\/\/www.computaex.es\/sites\/cenits.es\/files\/proyectos\/estirpex-2_1.png\" alt=\"\" width=\"287\" height=\"315\" \/><\/p><p>El proyecto\u00a0<a href=\"http:\/\/www.cenits.es\/proyectos\/estirpex\" target=\"_blank\" rel=\"noopener\">Estirpex\u00a0<\/a>supuso el despliegue de software libre en la infraestructura de\u00a0<a href=\"http:\/\/www.cenits.es\/cenits\/lusitania\">LUSITANIA<\/a>, para procesar la\u00a0secuencia gen\u00e9tica de determinados exomas, almacenar la\u00a0informaci\u00f3n generada y filtrar y visualizar los resultados\u00a0obtenidos; pero tambi\u00e9n, la apertura de una serie de l\u00edneas\u00a0de trabajo destinadas a la optimizaci\u00f3n de los procesos de\u00a0obtenci\u00f3n de informaci\u00f3n de alto nivel, relacionada con los\u00a0estudios de secuenciaci\u00f3n masiva realizados.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-estirpex-2\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-db16fc7 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"db16fc7\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-60c41c2 elementor-widget elementor-widget-text-editor\" data-id=\"60c41c2\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-cenital\/\">CENITAL<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li><a href=\"\/descripcion-cenits\/\">C\u00e9nitS<\/a><\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>El proyecto CENITAL naci\u00f3 en 2013 para dar respuesta a varios objetivos de la Fundaci\u00f3n COMPUTAEX, estando centrado especialmente en aspectos emergentes de las tecnolog\u00edas m\u00e1s avanzadas en materia de c\u00f3mputo y comunicaciones.\u00a0<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-cenital\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-f7a30f4 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"f7a30f4\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-feb7d09 elementor-widget elementor-widget-text-editor\" data-id=\"feb7d09\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-pedigreex-gestion-automatizada-de-pedigris-humanos-en-consejo-genetico\/\">PedigreeX: Gesti\u00f3n Automatizada de Pedigr\u00eds Humanos en Consejo Gen\u00e9tico<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Noelia Alonso S\u00e1nchez, C\u00e9nitS-COMPUTAEX. Trabajo Final de M\u00e1ster en Ingenier\u00eda Inform\u00e1tica, Universidad de Extremadura.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>El Consejo Gen\u00e9tico es una de las actividades propias de la Gen\u00e9tica Cl\u00ednica y consiste en un proceso comunicativo para informar, educar y dar soporte a individuos y familias que tienen una enfermedad gen\u00e9tica o el riesgo de tenerla. El Consejo Gen\u00e9tico les brinda a los pacientes informaci\u00f3n acerca de su enfermedad y les ayuda a tomar decisiones informadas. Un aspecto fundamental en dicho Consejo Gen\u00e9tico es la generaci\u00f3n y an\u00e1lisis del Pedigr\u00ed del paciente afecto, pero la carencia de una herramienta automatizada para ello complica la labor del especialista. Tras identificar las necesidades de los propios genetistas de nuestra regi\u00f3n se han analizado diferentes herramientas, ya desarrolladas, para trabajar con Pedigr\u00eds tanto de car\u00e1cter privativo como libre (Cyrillic, Progeny Clinical, GRAMPS, Madeline 2.0 PDE, GenoPro, PED, PELICAN, etc.), y ninguna de ellas integra totalmente las necesidades de los especialistas.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-pedigreex-gestion-automatizada-de-pedigris-humanos-en-consejo-genetico\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-a05ea78 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"a05ea78\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-8909db8 elementor-widget elementor-widget-text-editor\" data-id=\"8909db8\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-propuesta-y-analisis-de-viabilidad-de-un-sistema-automatizado-de-diagnostico-e-investigacion-aplicado-a-la-tecnologia-de-ultra-secuenciacion-genetica-en-un-centro-de-supercomputacion\/\">Propuesta y an\u00e1lisis de viabilidad de un sistema automatizado de diagn\u00f3stico e investigaci\u00f3n aplicado a la tecnolog\u00eda de ultra-secuenciaci\u00f3n gen\u00e9tica en un centro de supercomputaci\u00f3n<\/a><\/span><\/h2><\/header><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Manuel Alfonso L\u00f3pez Rourich. Trabajo Final de M\u00e1ster universitario en investigaci\u00f3n, Universidad de Extremadura.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Dentro de toda la gama de experimentos de secuenciaci\u00f3n gen\u00e9tica que la tecnolog\u00eda actual permite llevar a cabo, el m\u00e1s utilizado por los genetistas es el de resecuenciaci\u00f3n gen\u00e9tica. Es en sus dos \u00faltimas fases donde la bioinform\u00e1tica puede ser de gran ayuda, ya que se requiere la correcta orquestaci\u00f3n de una serie de elementos software para la obtenci\u00f3n de informaci\u00f3n gen\u00e9tica de alto nivel, que sea \u00fatil para el diagn\u00f3stico e investigaci\u00f3n de enfermedades cuyo origen es gen\u00e9tico.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-propuesta-y-analisis-de-viabilidad-de-un-sistema-automatizado-de-diagnostico-e-investigacion-aplicado-a-la-tecnologia-de-ultra-secuenciacion-genetica-en-un-centro-de-supercomputacion\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-38709f6 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"38709f6\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-369b63e elementor-widget elementor-widget-text-editor\" data-id=\"369b63e\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-desarrollo-de-nuevas-reacciones-multicomponentes-de-isonitrilos\/\">Desarrollo de nuevas reacciones multicomponentes de isonitrilos<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li><strong>Carlos Fern\u00e1ndez Marcos<\/strong>.\u00a0<a href=\"http:\/\/www.unex.es\/investigacion\/grupos\/quorex\">Departamento de Qu\u00edmica Org\u00e1nica e Inorg\u00e1nica<\/a>\u00a0de la\u00a0<a href=\"http:\/\/www.unex.es\/\">Universidad de Extremadura<\/a>.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Dada la gran demanda actual de productos con finalidades biom\u00e9dicas, la s\u00edntesis de compuestos bioactivos supone un reto para la investigaci\u00f3n en qu\u00edmica org\u00e1nica y qu\u00edmica m\u00e9dica. En nuestro grupo\u00a0 estamos interesados en el desarrollo de nuevas reacciones multicomponente de isonitrilos (RMCI) para la s\u00edntesis de compuestos de inter\u00e9s biol\u00f3gico.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-desarrollo-de-nuevas-reacciones-multicomponentes-de-isonitrilos\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-88e126b e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"88e126b\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-c4d903e elementor-widget elementor-widget-text-editor\" data-id=\"c4d903e\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-propuesta-y-analisis-de-viabilidad-de-un-servicio-asistencial-para-la-disposicion-de-ultra-secuenciacion-genetica-en-un-centro-de-supercomputacion\/\">Propuesta y an\u00e1lisis de viabilidad de un servicio asistencial para la disposici\u00f3n de ultra-secuenciaci\u00f3n gen\u00e9tica en un centro de supercomputaci\u00f3n<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Manuel Alfonso L\u00f3pez Rourich, C\u00e9nitS-COMPUTAEX. Trabajo Final de M\u00e1ster en Direcci\u00f3n TIC.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Este trabajo surge del proyecto de la Fundaci\u00f3n COMPUTAEX \u201c<a href=\"\/proyecto-ultrasecuenciacion-genetica-mediante-tecnicas-de-supercomputacion\/\">Ultrasecuenciaci\u00f3n gen\u00e9tica mediante t\u00e9cnicas de supercomputaci\u00f3n con LUSITANIA<\/a>\u201d, en donde se procesan secuencias gen\u00e9ticas procedentes de pacientes de la regi\u00f3n para estudiar enfermedades hereditarias y desarrollar tratamientos m\u00e9dicos personalizados.<\/p><p>La motivaci\u00f3n para el desarrollo del Trabajo vino dada principalmente por la capacidad de aportar valor (en forma de servicios) a ciertos sectores de la regi\u00f3n de Extremadura, gracias al desarrollo de las tecnolog\u00edas de secuenciaci\u00f3n de siguiente generaci\u00f3n (NGS), y con el apoyo de infraestructuras de supercomputaci\u00f3n dadas por el supercomputador LUSITANIA.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-propuesta-y-analisis-de-viabilidad-de-un-servicio-asistencial-para-la-disposicion-de-ultra-secuenciacion-genetica-en-un-centro-de-supercomputacion\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-9839f4e e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"9839f4e\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-343120a elementor-widget elementor-widget-text-editor\" data-id=\"343120a\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-estudio-cinetico-de-reacciones-poliatomicas-mediante-el-metodo-rpmd\/\">Estudio cin\u00e9tico de reacciones poliat\u00f3micas mediante el m\u00e9todo RPMD<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li><strong>Joaqu\u00edn Espinosa Garc\u00eda<\/strong>.\u00a0<a href=\"http:\/\/www.unex.es\/\">Universidad de Extremadura<\/a>.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>La cin\u00e9tica qu\u00edmica estudia los cambios que se producen en un sistema reactivo con la concentraci\u00f3n y el tiempo, lo que nos ayudar\u00e1 en la comprensi\u00f3n de su mecanismo de reacci\u00f3n.<\/p><\/div><\/div><\/div><\/div><h2 class=\"title\"><span style=\"color: #777777; font-family: 'Open Sans', Helvetica, Arial, sans-serif; font-size: 13px;\">.\u00a0<\/span><\/h2><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-estudio-cinetico-de-reacciones-poliatomicas-mediante-el-metodo-rpmd\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-fe66dd7 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"fe66dd7\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-41e612a elementor-widget elementor-widget-text-editor\" data-id=\"41e612a\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-estirpex\/\">Estirpex<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li><a href=\"\/descripcion-cenits\/\">C\u00e9nitS<\/a><\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Los avances en investigaci\u00f3n en el \u00e1mbito sanitario han sido siempre uno de los principales retos de la humanidad. Uno de los hallazgos m\u00e1s importantes ha sido determinar que el estudio de la secuencia de ADN permite conocer los procesos biol\u00f3gicos fundamentales del organismo y su funcionamiento. Hasta hace escasos a\u00f1os, secuenciar el ADN ten\u00eda un elevado coste econ\u00f3mico y temporal. Ante estos problemas, surgen las tecnolog\u00edas NGS, y con ellas un nuevo paradigma de secuenciaci\u00f3n gen\u00e9tica que permite la secuenciaci\u00f3n del genoma o de secciones de \u00e9ste a gran escala, con una importante disminuci\u00f3n del tiempo y del coste del proceso.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-estirpex\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-6feaaf0 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"6feaaf0\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-12fed4d elementor-widget elementor-widget-text-editor\" data-id=\"12fed4d\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-sulfur-dioxide-capture-by-ionic-liquids-from-a-molecular-point-of-view-a-density-functional-theory-study\/\">Sulfur Dioxide Capture by Ionic Liquids from a molecular point of view: A Density Functional Theory Study<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li><strong>Santiago Aparicio<\/strong>.\u00a0<a href=\"http:\/\/www.ubu.es\/ubu\/cm\/temas\/DepQuimica\">Departamente de Qu\u00edmica<\/a>\u00a0de la\u00a0<a href=\"http:\/\/www.ubu.es\/\">Universidad de Burgos<\/a>.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Air pollution is attracting an increasing attention through-out the world. SO2, mainly emitted from fossil-fuel combustion, is one of the main air pollutants. Besides, SO2 is also an important and useful source for many intermediates in chemical synthesis. Thus, to develop efficient techniques to control the emissions of SO2 would have a pivotal role for the use of fossil fuels from an environmental point of view. Nowadays, the most effective methods to control SO2 emissions from fossil fuel combustion are based on flue gas desulphurization (FGD) using several technologies such as water scrubbing, metal ion solution, catalytic oxidation, activated carbon adsorption, wet lime or limestone scrubbing, double alkali process, ammonia scrubbing, NH3 gas injection, and organic solvent absorption.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-sulfur-dioxide-capture-by-ionic-liquids-from-a-molecular-point-of-view-a-density-functional-theory-study\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-8bd06db e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"8bd06db\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-cd53ba2 elementor-widget elementor-widget-text-editor\" data-id=\"cd53ba2\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-unidad-interactiva-3d\/\">Unidad Interactiva 3D<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li><strong>Dr. Jes\u00fas Us\u00f3n Gargallo<\/strong>\u00a0&#8211; Coordinador de proyecto.<\/li><li>Personal de las Unidades de Laparoscopia, Microcirug\u00eda, Terapia Celular, etc.<\/li><li><strong>Mario Su\u00e1rez<\/strong>\u00a0&#8211; Especialista en Dise\u00f1o y Animaci\u00f3n 3D.<\/li><li><strong>Daniel Peguero<\/strong>\u00a0&#8211; Especialista en Software.<\/li><li><strong>Pablo Garc\u00eda Tres Palacios<\/strong>\u00a0&#8211; Profesional de Marketing.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>El proyecto contempla la creaci\u00f3n de una unidad especializada en aplicaciones multimedia dirigida a un mercado constituido por los profesionales sanitarios que se forman en el\u00a0<a href=\"http:\/\/www.ccmijesususon.com\/\">CCMIJU<\/a>, as\u00ed como usuarios y pacientes que puedan ser objeto de las t\u00e9cnicas que se describen y miembros de la sociedad en general, que tengan inter\u00e9s en conocer de una forma sencilla el procedimiento a seguir en el tratamiento intervencionista en una patolog\u00eda dada.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-unidad-interactiva-3d\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-f71d38e e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"f71d38e\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-7e9edb2 elementor-widget elementor-widget-text-editor\" data-id=\"7e9edb2\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\">\u00a0<span style=\"color: #000000;\"><a style=\"font-size: 14pt; font-family: Raleway, Helvetica, Arial, sans-serif; font-weight: 600; color: #000000;\" href=\"\/proyecto-construccion-de-superficies-de-energia-potencial\/\">Construcci\u00f3n de superficies de energ\u00eda potencial<\/a><\/span><\/div><\/div><\/div><\/div><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li><strong>Elo\u00edsa Gonz\u00e1lez Lavado<\/strong>. Departamento de\u00a0<a href=\"http:\/\/www.unex.es\/conoce-la-uex\/estructura-academica\/departamentos\/ficha_estructura?idDpto=Y063\">Ingenier\u00eda Qu\u00edmica y Qu\u00edmica Fisica<\/a>\u00a0(<a href=\"http:\/\/www.unex.es\/investigacion\/grupos\/gcydex\/\">GCYDEX<\/a>) de la\u00a0<a href=\"http:\/\/www.unex.es\/\">Universidad de Extremadura<\/a>.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Objetivos:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Construcci\u00f3n de superficies de energ\u00eda potencial en sistemas poliat\u00f3micos basada en c\u00e1lculos ab initio de alto nivel.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-metodologia field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Metodolog\u00eda:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Programas escritos en lenguaje\u00a0<strong>FORTRAN<\/strong>.<\/li><\/ul><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-construccion-de-superficies-de-energia-potencial\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-1a97736 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"1a97736\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-9fcf467 elementor-widget elementor-widget-text-editor\" data-id=\"9fcf467\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-estudio-teorico-de-la-fotofisica-y-fotoquimica-de-complejos-cromoforo-ciclodextrina-y-cromoforo-proteinas-pyp-y-gfp\/\">Estudio te\u00f3rico de la fotof\u00edsica y fotoqu\u00edmica de complejos crom\u00f3foro-ciclodextrina y crom\u00f3foro-prote\u00ednas PYP y GFP<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li><strong>Manuel \u00c1ngel Aguilar Espinosa<\/strong><\/li><li><strong>Francisco Javier Olivares del Valle<\/strong><\/li><li><strong>Jos\u00e9 Carlos Corchado Mart\u00edn-Romo<\/strong><\/li><li><strong>Mar\u00eda Luz S\u00e1nchez Mendoza<\/strong><\/li><li><strong>Mar\u00eda Elena Mart\u00edn Navarro<\/strong><\/li><li><strong>Ignacio Fern\u00e1ndez Galv\u00e1n<\/strong><\/li><li><strong>Aurora Mu\u00f1oz Losa<\/strong><\/li><li><strong>Francisco Fern\u00e1ndez Garc\u00eda-Prieto<\/strong><\/li><li><strong>Rute Maria Barata Morgado<\/strong><\/li><li><strong>Samuel Frutos Puerto<\/strong><\/li><\/ul><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-estudio-teorico-de-la-fotofisica-y-fotoquimica-de-complejos-cromoforo-ciclodextrina-y-cromoforo-proteinas-pyp-y-gfp\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-6420639 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"6420639\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-50fff70 elementor-widget elementor-widget-text-editor\" data-id=\"50fff70\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-nuevas-sustancias-gelificantes-derivadas-de-monosacaridos-e-hidrazidas-derivadas-de-diacidos\/\">Nuevas sustancias gelificantes derivadas de monosac\u00e1ridos e hidrazidas derivadas de di\u00e1cidos<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li><a title=\"Pedro Cintas Moreno\" href=\"http:\/\/www.unex.es\/conoce-la-uex\/estructura-academica\/departamentos\/ficha_personal?idDpto=Y062&amp;personal=1&amp;idPersonal=FCB3F61CA3BBFF327381FB7523AC5190\">Pedro Cintas Moreno<\/a>. Grupo de investigaci\u00f3n \u00ab<strong>Qu\u00edmica Org\u00e1nica<\/strong>\u00bb (<a title=\"Grupo de investigaci\u00f3n QUOREX\" href=\"http:\/\/www.unex.es\/investigacion\/grupos\/quorex\/\">QUOREX<\/a>). Departamento de\u00a0<a title=\"Departamento de Qu\u00edmica Org\u00e1nica e Inorg\u00e1nica\" href=\"http:\/\/www.unex.es\/conoce-la-uex\/estructura-academica\/departamentos\/ficha_estructura?idDpto=Y062&amp;estructura=1\">Qu\u00edmica Org\u00e1nica e Inorg\u00e1nica<\/a>\u00a0de la\u00a0<a title=\"Universidad de Extremadura\" href=\"http:\/\/www.unex.es\/\">Universidad de Extremadura<\/a>.<\/li><li><a href=\"http:\/\/www.unex.es\/investigacion\/grupos\/quorex\/estructura\/personal\/pagina_personal?listado_lineas=1&amp;idpersonal=21044\">Ana Mar\u00eda S\u00e1nchez Le\u00f3n<\/a>. Grupo de investigaci\u00f3n \u00ab<strong>Qu\u00edmica Org\u00e1nica<\/strong>\u00bb (<a title=\"Grupo de investigaci\u00f3n QUOREX\" href=\"http:\/\/www.unex.es\/investigacion\/grupos\/quorex\/\">QUOREX<\/a>). Departamento de\u00a0<a title=\"Departamento de Qu\u00edmica Org\u00e1nica e Inorg\u00e1nica\" href=\"http:\/\/www.unex.es\/conoce-la-uex\/estructura-academica\/departamentos\/ficha_estructura?idDpto=Y062&amp;estructura=1\">Qu\u00edmica Org\u00e1nica e Inorg\u00e1nica<\/a>\u00a0de la\u00a0<a title=\"Universidad de Extremadura\" href=\"http:\/\/www.unex.es\/\">Universidad de Extremadura<\/a>.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>En este proyecto de investigaci\u00f3n se pretende sintetizar mol\u00e9culas anf\u00edfilas y bolaanf\u00edfilas de distinta geometr\u00eda, fundamentalmente por reacci\u00f3n de aldosas con mol\u00e9culas que posean las funcionalidades apropiadas; en este caso, hidrazidas derivadas de di\u00e1cidos.<\/p><p>De la estructura de las nuevas mol\u00e9culas y de la naturaleza de los fragmentos que la compongan depender\u00e1n las propiedades que van a exhibir. Estas propiedades, adem\u00e1s de la capacidad de gelificaci\u00f3n (hidrogeles y organogeles), pueden estar relacionadas con la capacidad de generar diversos ensamblajes moleculares a trav\u00e9s de puentes de hidr\u00f3geno (entre restos polihidrox\u00edlicos, etc.), coordinaci\u00f3n con iones met\u00e1licos o cationes org\u00e1nicos (por ejemplo, grupos amonio), relaciones hu\u00e9sped-hospedador, etc., respuesta a diversos est\u00edmulos (fotoqu\u00edmicos, t\u00e9rmicos, electroqu\u00edmicos, etc.), reconocimiento molecular de mol\u00e9culas peque\u00f1as y materiales con propiedades especiales, tales como paramagn\u00e9ticos (portando radicales libres estables), sensores quimioluminiscentes y restos organomet\u00e1licos.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-nuevas-sustancias-gelificantes-derivadas-de-monosacaridos-e-hidrazidas-derivadas-de-diacidos\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-df3e6fe e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"df3e6fe\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-b67c8d5 elementor-widget elementor-widget-text-editor\" data-id=\"b67c8d5\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-quantum-chemistry-and-molecular-modeling\/\">Quantum Chemistry and Molecular Modeling<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li><a title=\"Francisco J. Olivares del Valle\" href=\"http:\/\/www.unex.es\/investigacion\/grupos\/qcamm\/estructura\/personal\/pagina_personal?listado_lineas=1&amp;idpersonal=977\">Francisco J. Olivares del Valle<\/a>. Grupo de investigaci\u00f3n\u00a0<a title=\"Quantum Chemistry And Molecular Modelling Group\" href=\"http:\/\/www.unex.es\/investigacion\/grupos\/qcamm\">Quantum Chemistry And Molecular Modelling<\/a>\u00a0de la\u00a0<a title=\"Universidad de Extremadura\" href=\"http:\/\/www.unex.es\/\">Universidad de Extremadura<\/a>.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Objetivos:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Estudio cu\u00e1ntico de las interacciones moleculares, fen\u00f3menos y\u00a0 procesos reactivos y no reactivos en fase condensada, tr\u00e1nsitos electr\u00f3nicos y espectroscop\u00eda molecular, procesos de inter\u00e9s biof\u00edsico y bioqu\u00edmico.<\/li><li>Modelizaci\u00f3n y simulaci\u00f3n molecular.<\/li><\/ul><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-quantum-chemistry-and-molecular-modeling\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-b2dcfe9 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"b2dcfe9\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-4d97a21 elementor-widget elementor-widget-text-editor\" data-id=\"4d97a21\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><span style=\"font-size: 14pt; color: #000000;\">\u00a0<\/span><a style=\"font-family: Raleway, Helvetica, Arial, sans-serif; font-size: 1.5625rem; font-weight: 600;\" href=\"\/proyecto-novel-genomic-regions-associated-to-specific-complex-chromatin-marks\/\"><span style=\"font-size: 14pt; color: #000000;\">Novel Genomic Regions associated to specific complex chromatin marks<\/span><\/a><\/div><\/div><\/div><\/div><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li><strong>Angel-Carlos Rom\u00e1n<\/strong>.\u00a0<a href=\"http:\/\/www.cajal.csic.es\/\">Instituto Cajal &#8211; CSIC<\/a>. Departamento\u00a0<em>Systems Circuits Group<\/em>.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Objetivos:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Detecci\u00f3n computacional de regiones gen\u00f3micas con patrones complejos en su cromatina asociada.<\/li><li>An\u00e1lisis de su conservaci\u00f3n (secuencia y vecindad) intra- e inter-especies.<\/li><li>An\u00e1lisis biol\u00f3gico de su funci\u00f3n usando modelos transg\u00e9nicos in vivo.<\/li><\/ul><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-novel-genomic-regions-associated-to-specific-complex-chromatin-marks\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-311fb5f e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"311fb5f\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-2c52647 elementor-widget elementor-widget-text-editor\" data-id=\"2c52647\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-electromagnetic-scattering-from-canonical-and-complicated-objects\/\">Electromagnetic scattering from canonical and complicated objects<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li><strong>Levent G\u00fcrel<\/strong>. Director,\u00a0<a href=\"http:\/\/www.cem.bilkent.edu.tr\/\">Computational Electromagnetics Research Center<\/a>\u00a0(<strong>BiLCEM<\/strong>)<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Fast and accurate solutions of electromagnetics problems are extremely important for realistic simulations of electromagnetic interactions between devices and their environments including living and no nliving objects.<\/p><p>Examples to real-life electromagnetics problems are radiation from antennas and their adverse effects on human health, indoor and outdoor propagation, optimizations of wireless systems, visualization via lens systems for microscopy, transmission through photonic crystals and metamaterials, detection with radar systems, light scattering from red blood cells to diagnose various diseases, and electromagnetic compatibility of novel electronic devices, to name a few.<\/p><p>Recently, we developed very efficient parallel implementations of the multilevel fast multipole algorithm (MLFMA) using novel parallelization strategies for high-performance computers. The developed implementations can be employed to a variety of problems in the aforementioned areas involving metallic and dielectric three-dimensional structures discretized with hundreds of millions of unknowns.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-electromagnetic-scattering-from-canonical-and-complicated-objects\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-ba0a227 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"ba0a227\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-1224ae3 elementor-widget elementor-widget-text-editor\" data-id=\"1224ae3\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><span style=\"font-size: 14pt; color: #000000;\">\u00a0<a style=\"font-family: Raleway, Helvetica, Arial, sans-serif; font-weight: 600; color: #000000;\" href=\"\/proyecto-quimica-computacional\/\">Qu\u00edmica Computacional<\/a><\/span><\/div><\/div><\/div><\/div><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li><a href=\"http:\/\/www.unex.es\/unex\/departamentos\/ficha_personal?idDpto=Y063&amp;personal=1&amp;idPersonal=68BEE5C275162286D79BCF02FA6C9D42\">Jos\u00e9 Carlos Corchado Mart\u00edn-Romo<\/a>\u00a0del departamento de\u00a0<a href=\"http:\/\/www.unex.es\/unex\/departamentos\/ficha_estructura?idDpto=Y063&amp;estructura=1\">Ingenier\u00eda Qu\u00edmica y Qu\u00edmica F\u00edsica<\/a>\u00a0de la\u00a0<a href=\"http:\/\/www.unex.es\/\">Universidad de Extremadura<\/a>.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Objetivos:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Desarrollar metodolog\u00edas para la simulaci\u00f3n de procesos de reactividad qu\u00edmica en fase gaseosa y en disoluci\u00f3n.<\/li><li>Estudio de propiedades fisico-qu\u00edmicas de mol\u00e9culas en fase l\u00edquida, gaseosa o en disoluci\u00f3n.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-metodologia field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Metodolog\u00eda:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Aplicaci\u00f3n al estudio de reacciones de inter\u00e9s atmosf\u00e9rico o biol\u00f3gico en fase gaseosa o condensada mediante la aplicaci\u00f3n de metodolog\u00edas cin\u00e9ticas (teor\u00edas del estado de transici\u00f3n) y din\u00e1micas (c\u00e1lculos de trayectorias cl\u00e1sicas, cuasicl\u00e1sicas o cu\u00e1nticas, c\u00e1lculos de din\u00e1mica molecular).<\/p><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-quimica-computacional\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-75e8a24 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"75e8a24\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-4c8f0b2 elementor-widget elementor-widget-text-editor\" data-id=\"4c8f0b2\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><span style=\"font-size: 14pt; color: #000000;\">\u00a0<a style=\"font-family: Raleway, Helvetica, Arial, sans-serif; font-weight: 600; color: #000000;\" href=\"\/proyecto-efecto-del-disolvente-sobre-la-desexcitacion-radiante-y-no-radiante-de-estados-excitados-en-moleculas-de-interes-biologico\/\">Efecto del disolvente sobre la desexcitaci\u00f3n radiante y no radiante de estados excitados en mol\u00e9culas de inter\u00e9s biol\u00f3gico<\/a><\/span><\/div><\/div><\/div><\/div><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>El grupo de investigaci\u00f3n\u00a0<a href=\"http:\/\/www.unex.es\/unex\/grupos\/grupos\/qcamm\">QCAMM<\/a>\u00a0(Quantum Chemistry And Molecular Modelling) del Departamento de Ingenier\u00eda Qu\u00edmica y F\u00edsica de la\u00a0<a href=\"http:\/\/www.unex.es\/\">Universidad de Extremadura<\/a>\u00a0est\u00e1 compuesto por los siguientes investigadores:<\/p><ul><li><strong>Francisco Javier Olivares del Valle (Coordinador del grupo)<\/strong><\/li><li><strong>Manuel \u00c1ngel Aguilar Espinosa<\/strong><\/li><li><strong>Jos\u00e9 Carlos Corchado Mart\u00edn-Romo<\/strong><\/li><li><strong>Mar\u00eda Luz S\u00e1nchez Mendoza<\/strong><\/li><li><strong>Mar\u00eda Elena Mart\u00edn Navarro<\/strong><\/li><li><strong>Ignacio Fern\u00e1ndez Galv\u00e1n<\/strong><\/li><li><strong>Aurora Mu\u00f1oz Losa<\/strong><\/li><li><strong>Francisco Fern\u00e1ndez Garc\u00eda-Prieto<\/strong><\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Objetivos:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>El principal objetivo del proyecto es el estudio te\u00f3rico de la \u00a0espectroscopia y evoluci\u00f3n temporal de estados excitados. M\u00e1s \u00a0espec\u00edficamente se pretende desarrollar un tratamiento te\u00f3rico unificado \u00a0que permita clarificar el papel que representa el disolvente en la \u00a0desexcitaci\u00f3n de estados excitados. Desde el punto de vista pr\u00e1ctico se pretende abordar problemas de gran inter\u00e9s como son la explicaci\u00f3n y \u00a0predicci\u00f3n de los espectros de emisi\u00f3n (fluorescencia y fosforescencia) de \u00a0mol\u00e9culas en disoluci\u00f3n o el efecto del disolvente sobre procesos fotoqu\u00edmicos en mol\u00e9culas de inter\u00e9s biol\u00f3gico: retinal, GFP, etc.<\/li><\/ul><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-efecto-del-disolvente-sobre-la-desexcitacion-radiante-y-no-radiante-de-estados-excitados-en-moleculas-de-interes-biologico\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-90809b6 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"90809b6\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-a945202 elementor-widget elementor-widget-text-editor\" data-id=\"a945202\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-simulacion-de-procesos-quimicos\/\">Simulaci\u00f3n de Procesos Qu\u00edmicos<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li><a href=\"http:\/\/www.unex.es\/unex\/grupos\/grupos\/eisqdm\">Santiago Tolosa Arroyo<\/a>\u00a0del Departamento de Ingenier\u00eda Qu\u00edmica y Qu\u00edmica F\u00edsica de la\u00a0<a href=\"http:\/\/www.unex.es\/\">Universidad de Extremadura<\/a><\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Objetivos:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Se realiza la simulaci\u00f3n de sistemas y procesos qu\u00edmicos de inter\u00e9s qu\u00edmico, biol\u00f3gico e industrial haciendo uso de mec\u00e1nica molecular para su estudio tanto en fase gas como en disoluci\u00f3n.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-metodologia field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Metodolog\u00eda:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Utilizaci\u00f3n de potenciales ab initio y de simulaci\u00f3n con din\u00e1mica molecular. Construcci\u00f3n de curvas de energ\u00eda libre.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-simulacion-de-procesos-quimicos\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-5052900 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"5052900\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-5444469 elementor-widget elementor-widget-text-editor\" data-id=\"5444469\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-ifmif-eveda-espana\/\">IFMIF-EVEDA Espa\u00f1a<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li><strong>Fernando Mota Garc\u00eda<\/strong>.\u00a0<a href=\"http:\/\/www-fusion.ciemat.es\/New_fusion\/es\/\" target=\"_blank\" rel=\"noopener\">Laboratorio Nacional de Fusi\u00f3n<\/a>.\u00a0<a href=\"http:\/\/www.ciemat.es\/\" target=\"_blank\" rel=\"noopener\">CIEMAT<\/a>.<\/li><li><strong>\u00c1ngela Garc\u00eda Sanz<\/strong>.\u00a0<a href=\"http:\/\/www-fusion.ciemat.es\/New_fusion\/es\/\" target=\"_blank\" rel=\"noopener\">Laboratorio Nacional de Fusi\u00f3n<\/a>.\u00a0<a href=\"http:\/\/www.ciemat.es\/\" target=\"_blank\" rel=\"noopener\">CIEMAT<\/a>.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Objetivos:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Dise\u00f1o y desarrollo del prototipo del acelerador de\u00a0<strong>IFMIF<\/strong>\u00a0(International Fusion Materials Irradiation Facility) llamado\u00a0<a href=\"http:\/\/irfu.cea.fr\/en\/Phocea\/Vie_des_labos\/Ast\/ast_technique.php?id_ast=2271\" target=\"_blank\" rel=\"noopener\">IFMIF-EVEDA<\/a>\u00a0(construy\u00e9ndose en Rokkaso &#8211; Jap\u00f3n).<\/li><li>Desarrollo del dise\u00f1o de la instalaci\u00f3n\u00a0<strong>IFMIF<\/strong>.<\/li><li>Colaboraci\u00f3n en los desarrollos de los m\u00f3dulos del Test Cell (\u00e1rea de irradiaci\u00f3n) y en el desarrollo de todo el sistema de\u00a0<strong>Remote Handling<\/strong>.<\/li><\/ul><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-ifmif-eveda-espana\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t<div class=\"elementor-element elementor-element-f8b65ee elementor-widget elementor-widget-text-editor\" data-id=\"f8b65ee\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><span style=\"color: #000000; font-size: 14pt;\">\u00a0<a style=\"font-family: Raleway, Helvetica, Arial, sans-serif; font-weight: 600; color: #000000;\" href=\"\/proyecto-consolider-tecno_fus\/\">Consolider TECNO_FUS<\/a><\/span><\/div><\/div><\/div><\/div><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores<\/strong>:\u00a0<\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li><strong>Jos\u00e9 M\u00aa G\u00f3mez Ros<\/strong>.\u00a0<a href=\"http:\/\/www.ciemat.es\/\">CIEMAT<\/a>.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Objetivos:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li><a href=\"http:\/\/www.tecnofus.net\/\">Consolider TECNO_FUS<\/a>\u00a0propone el lanzamiento de un nuevo Programa de Tecnolog\u00eda de Fusi\u00f3n en Espa\u00f1a.\u00a0TECNO_FUS es un programa orientado que integra interactivamente \u00e1reas clave de la tecnolog\u00eda de fusi\u00f3n. Las actividades se articulan alrededor del desarrollo de un concepto de envoltura regeneradora y sus sistemas auxiliares \u00abde planta\u00bb.<\/li><li>Atendiendo a sus requisitos funcionales como componente: integridad estructural, blindaje de la radiaci\u00f3n, eficiencia en la extracci\u00f3n de potencia y garant\u00edas de regeneraci\u00f3n de combustible; la envoltura regeneradora es probablemente el componente m\u00e1s complejo desarrollado hoy por la tecnolog\u00eda energ\u00e9tica. Los sistemas envoltura son clave en reactores de producci\u00f3n de potencia por fusi\u00f3n y sus desarrollos cruciales en el camino de la fusi\u00f3n hacia la producci\u00f3n energ\u00e9tica masiva. La propuesta Consolider TECNO_FUS responde al objetivo estrat\u00e9gico del programa de fusi\u00f3n espa\u00f1ol de alcanzar capacidades de dise\u00f1o de un reactor de potencia (DEMO) en la pr\u00f3xima d\u00e9cada.<\/li><\/ul><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-consolider-tecno_fus\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-eb44d83 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"eb44d83\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-06390a2 elementor-widget elementor-widget-text-editor\" data-id=\"06390a2\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><a href=\"\/proyecto-quorex\/\"><span style=\"font-size: 14pt;\">QUOREX<\/span><\/a><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li><strong>Pedro Cintas Moreno (Coordinador), Mart\u00edn \u00c1valos Gonz\u00e1lez, Reyes Babiano Caballero, Jos\u00e9 Luis Jim\u00e9nez Requejo, Rafael Fernando Mart\u00ednez V\u00e1zquez, Juan Carlos Palacios Albarr\u00e1n, Abraham Rodr\u00edguez Cano<\/strong>. Investigadores del Grupo\u00a0<a href=\"http:\/\/www.unex.es\/investigacion\/grupos\/quorex\" target=\"_blank\" rel=\"noopener\">QUOREX<\/a>. Universidad de Extremadura.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>El grupo de investigaci\u00f3n\u00a0<a href=\"http:\/\/www.unex.es\/investigacion\/grupos\/quorex\/\">QUOREX<\/a>\u00a0de\u00a0<strong>Qu\u00edmica Org\u00e1nica<\/strong>, catalogado tanto en la\u00a0<strong>Universidad de Extremadura<\/strong>\u00a0como en la\u00a0<strong>Junta de Extremadura<\/strong>\u00a0(FQM-007), est\u00e1 integrado por docentes e investigadores cuyas l\u00edneas de trabajo se encuentran financiadas a trav\u00e9s de proyectos nacionales (<a href=\"http:\/\/www.micinn.es\/\" target=\"_blank\" rel=\"noopener\">Ministerio de Ciencia e Innovaci\u00f3n<\/a>) y regionales (<a href=\"http:\/\/www.juntaex.es\/consejerias\/economia-comercio-innovacion\/index-ides-idweb.html\" target=\"_blank\" rel=\"noopener\">Consejer\u00eda de Econom\u00eda, Comercio e Innovaci\u00f3n<\/a>).<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-quorex\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t<div class=\"elementor-element elementor-element-5761730 elementor-widget elementor-widget-text-editor\" data-id=\"5761730\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-dinamica-fuera-del-equilibrio-del-modelo-de-heisenberg-tridimensional-en-presencia-de-un-campo-magnetico\/\">Din\u00e1mica fuera del equilibrio del modelo de Heisenberg tridimensional en presencia de un campo magn\u00e9tico<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li><strong>Juan Jes\u00fas Ruiz Lorenzo<\/strong>\u00a0del Departamento de F\u00edsica de la\u00a0<a href=\"http:\/\/www.unex.es\/\">Universidad de Extremadura<\/a>.<\/li><li><strong>Antonio Gordillo Guerrero<\/strong>\u00a0del departamento de Ingenier\u00eda El\u00e9ctrica, Electr\u00f3nica y Autom\u00e1tica de la\u00a0<a href=\"http:\/\/www.unex.es\/\">Universidad de Extremadura<\/a>.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Objetivos:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Simular el modelo de Heisenberg spin glass en tres dimensiones en presencia de campo magn\u00e9tico externo.<\/li><li>Intentar reproducir los importantes resultados experimentales de memoria y rejuvenecimiento (grupo de P. Nordblad et al.).<\/li><li>Caracterizar mediante m\u00e9todos de din\u00e1mica fuera del equilibrio la existencia de transici\u00f3n de fase en presencia de campo magn\u00e9tico.<\/li><\/ul><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-dinamica-fuera-del-equilibrio-del-modelo-de-heisenberg-tridimensional-en-presencia-de-un-campo-magnetico\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t<div class=\"elementor-element elementor-element-713c6f1 elementor-widget elementor-widget-text-editor\" data-id=\"713c6f1\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-calculo-de-la-corriente-de-bootstrap-en-el-stellarator-tj-ii\/\">C\u00e1lculo de la corriente de bootstrap en el Stellarator TJ-II<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li><strong>Jos\u00e9 Luis Velasco Garasa<\/strong>\u00a0del Laboratorio Nacional de Fusi\u00f3n del\u00a0<strong>CIEMAT<\/strong>\u00a0(<a href=\"http:\/\/www.ceta-ciemat.es\/\" target=\"_blank\" rel=\"noopener\">Centro de Investigaciones Energ\u00e9ticas, Medioambientales y Tecnol\u00f3gicas<\/a>)<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Objetivos:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>El objetivo es calcular el perfil radial de la corriente de boostrap en el stellarator TJ-II. \u00c9sta es una corriente neocl\u00e1sica, paralela al campo magn\u00e9tico, que aparece en todos los dispositivos de confinamiento magn\u00e9tico de plasmas. Se forma debido a la combinaci\u00f3n de dos efectos: atrapamiento de part\u00edculas debido a la variaci\u00f3n en la fuerza del campo magn\u00e9tico y gradientes radiales de temperatura y\/o densidad.<\/li><li>El control de la corriente de bootstrap podr\u00eda dar lugar a la posibilidad de operaci\u00f3n cont\u00ednua en los dispositivos tokamaks. Por otra parte, en stellarators, permite un mejor control de la transformada rotacional y, por tanto, el acceso a reg\u00edmenes de transporte mejorado.<\/li><li>El c\u00e1lculo preciso de la bootstrap es un desaf\u00edo num\u00e9rico. Para ello, la Universidad T\u00e9cnica de Graz (TU Graz, Austria) ha creado el nuevo c\u00f3digo NEO-MC. Este c\u00f3digo har\u00e1 posible, por primera vez, el c\u00e1culo de la corriente de bootstrap en el stellarator TJ-II, sito en Madrid.<\/li><\/ul><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-calculo-de-la-corriente-de-bootstrap-en-el-stellarator-tj-ii\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-554896f e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"554896f\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-40f79a9 elementor-widget elementor-widget-text-editor\" data-id=\"40f79a9\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-gcydex-superficies-de-energia-potencial-en-sistemas-poliatomicos-estudios-cineticos-y-dinamicos-teoricos\/\">GCYDEX. Superficies de energ\u00eda potencial en sistemas poliat\u00f3micos. Estudios cin\u00e9ticos y din\u00e1micos te\u00f3ricos<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li><strong>Joaqu\u00edn Espinosa Garc\u00eda<\/strong>\u00a0(IP,\u00a0<strong>UEx<\/strong>).<\/li><li><strong>Jos\u00e9 C. Corchado Mart\u00edn-Romo<\/strong>\u00a0(<strong>UEx<\/strong>).<\/li><li><strong>Cipriano Rangel Delgado<\/strong>\u00a0(<strong>UEx<\/strong>).<\/li><li><strong>Manuel Monge Palacios<\/strong>\u00a0(<strong>UEx<\/strong>).<\/li><li><strong>Juan de la C. Garc\u00eda Bern\u00e1ldez<\/strong>\u00a0(<strong>UEx<\/strong>).<\/li><li><strong>Alberto Cabello S\u00e1nchez<\/strong>\u00a0(<strong>UEx<\/strong>).<\/li><li><strong>Jos\u00e9 L. Bravo Trinidad<\/strong>\u00a0(<strong>UEx<\/strong>).<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>Nuestro campo de investigaci\u00f3n se centra en el estudio cin\u00e9tico y din\u00e1mico te\u00f3rico de sistemas poliat\u00f3micos en fase gaseosa, basado en el conocimiento de las superficies de energ\u00eda potencial (SEP). Un reto importante en esta investigaci\u00f3n es la evoluci\u00f3n desde los bien estudiados sistemas \u00e1tomo+di\u00e1tomo a los sistemas poliat\u00f3micos.Este proyecto se desarrolla dentro del grupo de investigaci\u00f3n GCYDEX (Grupo de Cin\u00e9tica y Din\u00e1mica de la\u00a0<strong>Universidad de Extremadura<\/strong>).Las superficies de energ\u00eda potencial desempe\u00f1an un papel central en la completa descripci\u00f3n de un sistema reactivo. Las SEP se construyen como formas funcionales describiendo los modos de tensi\u00f3n, flexi\u00f3n y torsi\u00f3n, y se ajustan a c\u00e1lculos ab initio de estructura electr\u00f3nica de alto nivel.Basados sobre estas SEP, la informaci\u00f3n cin\u00e9tica se obtiene usando la Teor\u00eda Variacional del Estado de Transici\u00f3n (VTST) con inclusi\u00f3n del efecto t\u00fanel mecanocu\u00e1ntico; mientras que la informaci\u00f3n din\u00e1mica se obtiene usando c\u00e1lculos de trayectorias cuasi-cl\u00e1sicas (QCT).Las \u00e1reas de aplicaci\u00f3n incluyen qu\u00edmica de combusti\u00f3n y atmosf\u00e9rica, as\u00ed como cat\u00e1lisis y bioqu\u00edmica.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-gcydex-superficies-de-energia-potencial-en-sistemas-poliatomicos-estudios-cineticos-y-dinamicos-teoricos\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t<div class=\"elementor-element elementor-element-4127e30 elementor-widget elementor-widget-text-editor\" data-id=\"4127e30\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-simulaciones-girocineticas-globales-de-plasmas-de-fusion-con-euterpe\/\">Simulaciones girocin\u00e9ticas globales de plasmas de fusi\u00f3n con EUTERPE<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li><strong>Edilberto S\u00e1nchez Gonz\u00e1lez<\/strong>.<\/li><li><strong>Francisco Castej\u00f3n Maga\u00f1a<\/strong>.<\/li><li><strong>Iv\u00e1n Calvo Rubio<\/strong>.<\/li><li>Pertenecientes a la Unidad de Teor\u00eda del Laboratorio Nacional de Fusi\u00f3n del\u00a0<a href=\"http:\/\/www.ciemat.es\/\">CIEMAT<\/a>.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Descripci\u00f3n:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><p>La actividad se centra en la simulaci\u00f3n detallada de turbulencia en plasmas. Se enmarca dentro de dos proyectos financiados por el\u00a0<a href=\"http:\/\/www.micinn.es\/\" target=\"_blank\" rel=\"noopener\">Ministerio de Ciencia e Innovaci\u00f3n<\/a>, dedicados al desarrollo de m\u00e9todos cin\u00e9ticos para el estudio de plasmas confinados magn\u00e9ticamente, y a la investigaci\u00f3n de la influencia de los flujos globales y su topolog\u00eda en el transporte de plasmas turbulentos, respectivamente.<\/p><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-simulaciones-girocineticas-globales-de-plasmas-de-fusion-con-euterpe\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-0132123 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"0132123\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-e07c8d8 elementor-widget elementor-widget-text-editor\" data-id=\"e07c8d8\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><span style=\"font-size: 14pt; color: #000000;\">\u00a0<a style=\"font-family: Raleway, Helvetica, Arial, sans-serif; font-weight: 600; color: #000000;\" href=\"\/proyecto-medida-de-dosis-neutronicas-en-pacientes-sometidos-a-radioterapia\/\">Medida de dosis neutr\u00f3nicas en pacientes sometidos a radioterapia<\/a><\/span><\/div><\/div><\/div><\/div><header><div class=\"contextual-links-wrapper contextual-links-processed\">\u00a0<\/div><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li><strong>Juan Ignacio Lagares<\/strong>\u00a0perteneciente a la Unidad de Aplicaciones M\u00e9dicas del\u00a0<a href=\"http:\/\/www.ciemat.es\/\">CIEMAT<\/a>.<\/li><li><strong>Francisco S\u00e1nchez Doblado<\/strong>\u00a0y\u00a0<strong>Mar\u00eda Teresa Romero Exp\u00f3sito<\/strong>, del Departamente de Fisiolog\u00eda M\u00e9dica y Biof\u00edsica\/Servicio de Radiof\u00edsica de la Facultad de Medicina de la\u00a0<a href=\"http:\/\/www.us.es\/\">Universidad de Sevilla<\/a>.<\/li><li>Financiado por el\u00a0<a href=\"http:\/\/www.csn.es\/\">Consejo de Seguridad Nuclear<\/a>.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Objetivos:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>El objeto del proyecto es la utilizaci\u00f3n de un dispositivo digital, que se sit\u00faa en la sala de irradiaci\u00f3n, capaz de evaluar la contribuci\u00f3n neutr\u00f3nica a las dosis equivalentes recibidas en distintos \u00f3rganos del paciente durante el tratamiento. Esto permitir\u00e1, de forma operativa, la valoraci\u00f3n del riesgo radiol\u00f3gico asociado a la presencia de neutrones. Este nuevo dato permitir\u00e1 una mejor elecci\u00f3n de la estrategia terap\u00e9utica, entre las posibles, para lograr disminuir la probabilidad de adquirir una nueva neoplasia por radioinducci\u00f3n.<\/li><li>Se ha dise\u00f1ado un fantoma antropom\u00f3rfico que est\u00e1 permitiendo obtener un conjunto de medidas en el paciente, dentro de un amplio margen de incertidumbre, al hacerle incidir haces geom\u00e9tricos simples y diversos tipos de tratamientos completos. El uso de maniqu\u00eds de diferentes tama\u00f1os permitir\u00e1 la valoraci\u00f3n en ni\u00f1os y adultos. Estos experimentos cubrir\u00e1n la mayor\u00eda de las situaciones cl\u00ednicas comunes en los aceleradores de diversos fabricantes con energ\u00edas comprendidas entre 15 y 23 MV. Tambi\u00e9n se contempla la geometr\u00eda de la sala de tratamiento, en t\u00e9rminos del tama\u00f1o del bunker.<\/li><li>El estudio dosimetrico con diferentes detectores y su correlaci\u00f3n con las medidas del dispositivo digital permitir\u00e1 lograr los objetivo del proyecto. Dadas las particularidad de la dosimetr\u00eda de neutrones, el estudio de los espectros neutr\u00f3nicos con simulaciones Monte Carlo es fundamental para establecer correctamente las respuestas dosimetricas de los diferentes detectores y dar coherencia al grupo de medidas.<\/li><li>En resumen, el resultado esperado de este proyecto de toma de medidas de dosis neutr\u00f3nicas en pacientes sometidos a radioterapia es lograr la selecci\u00f3n \u00f3ptima de las estrategias de tratamiento que reduzcan el riesgo de la radioinducci\u00f3n.<\/li><\/ul><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-medida-de-dosis-neutronicas-en-pacientes-sometidos-a-radioterapia\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t<div class=\"elementor-element elementor-element-855ec19 e-flex e-con-boxed wpr-particle-no wpr-jarallax-no wpr-parallax-no wpr-sticky-section-no e-con e-parent\" data-id=\"855ec19\" data-element_type=\"container\" data-e-type=\"container\">\n\t\t\t\t\t<div class=\"e-con-inner\">\n\t\t\t\t<div class=\"elementor-element elementor-element-2251987 elementor-widget elementor-widget-text-editor\" data-id=\"2251987\" data-element_type=\"widget\" data-e-type=\"widget\" data-widget_type=\"text-editor.default\">\n\t\t\t\t<div class=\"elementor-widget-container\">\n\t\t\t\t\t\t\t\t\t<header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-descripcion field-type-text-long field-label-above\"><div class=\"field-items\"><div class=\"field-item even\"><header><header><h2 class=\"title\"><span style=\"font-size: 14pt;\"><a href=\"\/proyecto-solucion-de-problemas-electromagneticos-de-grandes-dimensiones\/\">Soluci\u00f3n de problemas electromagn\u00e9ticos de grandes dimensiones<\/a><\/span><\/h2><\/header><div class=\"content node-proyecto\"><div class=\"field field-name-field-proy-investigadores field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Investigadores:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li><strong>Luis Landesa<\/strong>\u00a0y\u00a0<strong>Jos\u00e9 Manuel Taboada<\/strong>\u00a0del Departamento de Tecnolog\u00eda de los Computadores y de las Comunicaciones de la\u00a0<a href=\"http:\/\/www.unex.es\/\">Universidad de Extremadura<\/a>.<\/li><\/ul><\/div><\/div><\/div><div class=\"field field-name-field-proy-objetivos field-type-text-long field-label-above\"><div class=\"field-label\"><strong>Objetivos:\u00a0<\/strong><\/div><div class=\"field-items\"><div class=\"field-item even\"><ul><li>Evaluar los l\u00edmites del supercomputador Lusitania para la soluci\u00f3n de grandes problemas electromagn\u00e9ticos.<\/li><li>Concluir nuevas metodolog\u00edas que se adapten mejor a la\u00a0<a href=\"https:\/\/www.computaex.es\/cenits\/lusitania\/caracteristicas-lusitania\">arquitectura de Lusitania<\/a>.<\/li><li>Realizaci\u00f3n de, al menos, las fases previas de un nuevo reto mundial en computaci\u00f3n electromagn\u00e9tica con 1.000 millones de inc\u00f3gnitas.<\/li><li>Explotaci\u00f3n de resultados.<\/li><li>Problemas electromagn\u00e9ticos relacionados con los nuevos sistemas de seguridad en automoci\u00f3n.<\/li><li>Estudios de compatibilidad electromagn\u00e9tica, interferencia electromagn\u00e9tica, niveles de radiaci\u00f3n, predicci\u00f3n de secci\u00f3n radar, im\u00e1genes radar, todos ellos de gran inter\u00e9s en el dise\u00f1o de todo tipo de veh\u00edculos y plataformas complejas.<\/li><li>Otras aplicaciones incluyen el estudio de los efectos de las radiaciones electromagn\u00e9ticas en el cuerpo humano, radares de penetraci\u00f3n, estudios avanzados en nuevos materiales y metamateriales, etc.<\/li><\/ul><\/div><\/div><\/div><\/div><\/header><\/div><\/div><\/div><\/div><\/div><\/div><\/div><\/div><p style=\"text-align: right;\"><a href=\"\/proyecto-solucion-de-problemas-electromagneticos-de-grandes-dimensiones\/\">Leer mas<\/a><\/p><\/div><\/div><\/div><\/div>\t\t\t\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t\t\t<\/div>\n\t\t","protected":false},"excerpt":{"rendered":"<p>Corrosion inhibition from first principles: the role of the oxide Investigadores:\u00a0 Investigador principal:\u00a0Pablo Ordej\u00f3n. Investigadores:\u00a0Alberto Garc\u00eda Arribas,\u00a0Jos\u00e9 Mar\u00ed\u00ada Castillo Robles,\u00a0Pol Febrer,\u00a0Roberta Farris,\u00a0Jos\u00e9 Mar\u00eda Escart\u00edn,\u00a0Vladimir Dikan,\u00a0Irina Lebedeva,\u00a0Federico Pedr\u00f3n,\u00a0Catalina Coll. Descripci\u00f3n:\u00a0 Corrosion &#8230;<\/p>","protected":false},"author":1,"featured_media":0,"parent":0,"menu_order":0,"comment_status":"closed","ping_status":"closed","template":"","meta":{"footnotes":""},"categories":[],"tags":[],"class_list":["post-3769","page","type-page","status-publish","hentry"],"yoast_head":"<!-- This site is optimized with the Yoast SEO plugin v27.1.1 - https:\/\/yoast.com\/product\/yoast-seo-wordpress\/ -->\n<title>Ciencias de la Vida - Fundaci\u00f3n COMPUTAEX<\/title>\n<meta name=\"robots\" content=\"index, follow, max-snippet:-1, max-image-preview:large, max-video-preview:-1\" \/>\n<link rel=\"canonical\" href=\"https:\/\/computaex.es\/en\/ciencias-de-la-vida\/\" \/>\n<meta property=\"og:locale\" content=\"en_US\" \/>\n<meta property=\"og:type\" content=\"article\" \/>\n<meta property=\"og:title\" content=\"Ciencias de la Vida - Fundaci\u00f3n COMPUTAEX\" \/>\n<meta property=\"og:description\" content=\"Corrosion inhibition from first principles: the role of the oxide Investigadores:\u00a0 Investigador principal:\u00a0Pablo Ordej\u00f3n. Investigadores:\u00a0Alberto Garc\u00eda Arribas,\u00a0Jos\u00e9 Mar\u00ed\u00ada Castillo Robles,\u00a0Pol Febrer,\u00a0Roberta Farris,\u00a0Jos\u00e9 Mar\u00eda Escart\u00edn,\u00a0Vladimir Dikan,\u00a0Irina Lebedeva,\u00a0Federico Pedr\u00f3n,\u00a0Catalina Coll. Descripci\u00f3n:\u00a0 Corrosion ...\" \/>\n<meta property=\"og:url\" content=\"https:\/\/computaex.es\/en\/ciencias-de-la-vida\/\" \/>\n<meta property=\"og:site_name\" content=\"Fundaci\u00f3n COMPUTAEX\" \/>\n<meta property=\"article:publisher\" content=\"https:\/\/m.facebook.com\/computaex\/\" \/>\n<meta property=\"article:modified_time\" content=\"2025-01-23T09:39:00+00:00\" \/>\n<meta property=\"og:image\" content=\"https:\/\/www.computaex.es\/sites\/cenits.es\/files\/proyectos\/estirpex-2_1.png\" \/>\n<meta name=\"twitter:card\" content=\"summary_large_image\" \/>\n<meta name=\"twitter:site\" content=\"@computaex\" \/>\n<meta name=\"twitter:label1\" content=\"Est. reading time\" \/>\n\t<meta name=\"twitter:data1\" content=\"21 minutes\" \/>\n<script type=\"application\/ld+json\" class=\"yoast-schema-graph\">{\"@context\":\"https:\/\/schema.org\",\"@graph\":[{\"@type\":\"WebPage\",\"@id\":\"https:\/\/computaex.es\/ciencias-de-la-vida\/\",\"url\":\"https:\/\/computaex.es\/ciencias-de-la-vida\/\",\"name\":\"Ciencias de la Vida - Fundaci\u00f3n COMPUTAEX\",\"isPartOf\":{\"@id\":\"https:\/\/computaex.es\/#website\"},\"primaryImageOfPage\":{\"@id\":\"https:\/\/computaex.es\/ciencias-de-la-vida\/#primaryimage\"},\"image\":{\"@id\":\"https:\/\/computaex.es\/ciencias-de-la-vida\/#primaryimage\"},\"thumbnailUrl\":\"https:\/\/www.computaex.es\/sites\/cenits.es\/files\/proyectos\/estirpex-2_1.png\",\"datePublished\":\"2025-01-16T09:30:08+00:00\",\"dateModified\":\"2025-01-23T09:39:00+00:00\",\"breadcrumb\":{\"@id\":\"https:\/\/computaex.es\/ciencias-de-la-vida\/#breadcrumb\"},\"inLanguage\":\"en-US\",\"potentialAction\":[{\"@type\":\"ReadAction\",\"target\":[\"https:\/\/computaex.es\/ciencias-de-la-vida\/\"]}]},{\"@type\":\"ImageObject\",\"inLanguage\":\"en-US\",\"@id\":\"https:\/\/computaex.es\/ciencias-de-la-vida\/#primaryimage\",\"url\":\"https:\/\/www.computaex.es\/sites\/cenits.es\/files\/proyectos\/estirpex-2_1.png\",\"contentUrl\":\"https:\/\/www.computaex.es\/sites\/cenits.es\/files\/proyectos\/estirpex-2_1.png\"},{\"@type\":\"BreadcrumbList\",\"@id\":\"https:\/\/computaex.es\/ciencias-de-la-vida\/#breadcrumb\",\"itemListElement\":[{\"@type\":\"ListItem\",\"position\":1,\"name\":\"Portada\",\"item\":\"https:\/\/computaex.es\/\"},{\"@type\":\"ListItem\",\"position\":2,\"name\":\"Ciencias de la Vida\"}]},{\"@type\":\"WebSite\",\"@id\":\"https:\/\/computaex.es\/#website\",\"url\":\"https:\/\/computaex.es\/\",\"name\":\"Fundaci\u00f3n COMPUTAEX\",\"description\":\"COMPUTAEX\",\"publisher\":{\"@id\":\"https:\/\/computaex.es\/#organization\"},\"potentialAction\":[{\"@type\":\"SearchAction\",\"target\":{\"@type\":\"EntryPoint\",\"urlTemplate\":\"https:\/\/computaex.es\/?s={search_term_string}\"},\"query-input\":{\"@type\":\"PropertyValueSpecification\",\"valueRequired\":true,\"valueName\":\"search_term_string\"}}],\"inLanguage\":\"en-US\"},{\"@type\":\"Organization\",\"@id\":\"https:\/\/computaex.es\/#organization\",\"name\":\"COMPUTAEX\",\"url\":\"https:\/\/computaex.es\/\",\"logo\":{\"@type\":\"ImageObject\",\"inLanguage\":\"en-US\",\"@id\":\"https:\/\/computaex.es\/#\/schema\/logo\/image\/\",\"url\":\"https:\/\/computaex.es\/wp-content\/uploads\/2025\/05\/cropped-COMPUTAEX_transparente-scaled-1.png\",\"contentUrl\":\"https:\/\/computaex.es\/wp-content\/uploads\/2025\/05\/cropped-COMPUTAEX_transparente-scaled-1.png\",\"width\":2560,\"height\":970,\"caption\":\"COMPUTAEX\"},\"image\":{\"@id\":\"https:\/\/computaex.es\/#\/schema\/logo\/image\/\"},\"sameAs\":[\"https:\/\/m.facebook.com\/computaex\/\",\"https:\/\/x.com\/computaex\",\"https:\/\/es.linkedin.com\/company\/cenits\"]}]}<\/script>\n<!-- \/ Yoast SEO plugin. -->","yoast_head_json":{"title":"Ciencias de la Vida - Fundaci\u00f3n COMPUTAEX","robots":{"index":"index","follow":"follow","max-snippet":"max-snippet:-1","max-image-preview":"max-image-preview:large","max-video-preview":"max-video-preview:-1"},"canonical":"https:\/\/computaex.es\/en\/ciencias-de-la-vida\/","og_locale":"en_US","og_type":"article","og_title":"Ciencias de la Vida - Fundaci\u00f3n COMPUTAEX","og_description":"Corrosion inhibition from first principles: the role of the oxide Investigadores:\u00a0 Investigador principal:\u00a0Pablo Ordej\u00f3n. Investigadores:\u00a0Alberto Garc\u00eda Arribas,\u00a0Jos\u00e9 Mar\u00ed\u00ada Castillo Robles,\u00a0Pol Febrer,\u00a0Roberta Farris,\u00a0Jos\u00e9 Mar\u00eda Escart\u00edn,\u00a0Vladimir Dikan,\u00a0Irina Lebedeva,\u00a0Federico Pedr\u00f3n,\u00a0Catalina Coll. Descripci\u00f3n:\u00a0 Corrosion ...","og_url":"https:\/\/computaex.es\/en\/ciencias-de-la-vida\/","og_site_name":"Fundaci\u00f3n COMPUTAEX","article_publisher":"https:\/\/m.facebook.com\/computaex\/","article_modified_time":"2025-01-23T09:39:00+00:00","og_image":[{"url":"https:\/\/www.computaex.es\/sites\/cenits.es\/files\/proyectos\/estirpex-2_1.png","type":"","width":"","height":""}],"twitter_card":"summary_large_image","twitter_site":"@computaex","twitter_misc":{"Est. reading time":"21 minutes"},"schema":{"@context":"https:\/\/schema.org","@graph":[{"@type":"WebPage","@id":"https:\/\/computaex.es\/ciencias-de-la-vida\/","url":"https:\/\/computaex.es\/ciencias-de-la-vida\/","name":"Ciencias de la Vida - Fundaci\u00f3n COMPUTAEX","isPartOf":{"@id":"https:\/\/computaex.es\/#website"},"primaryImageOfPage":{"@id":"https:\/\/computaex.es\/ciencias-de-la-vida\/#primaryimage"},"image":{"@id":"https:\/\/computaex.es\/ciencias-de-la-vida\/#primaryimage"},"thumbnailUrl":"https:\/\/www.computaex.es\/sites\/cenits.es\/files\/proyectos\/estirpex-2_1.png","datePublished":"2025-01-16T09:30:08+00:00","dateModified":"2025-01-23T09:39:00+00:00","breadcrumb":{"@id":"https:\/\/computaex.es\/ciencias-de-la-vida\/#breadcrumb"},"inLanguage":"en-US","potentialAction":[{"@type":"ReadAction","target":["https:\/\/computaex.es\/ciencias-de-la-vida\/"]}]},{"@type":"ImageObject","inLanguage":"en-US","@id":"https:\/\/computaex.es\/ciencias-de-la-vida\/#primaryimage","url":"https:\/\/www.computaex.es\/sites\/cenits.es\/files\/proyectos\/estirpex-2_1.png","contentUrl":"https:\/\/www.computaex.es\/sites\/cenits.es\/files\/proyectos\/estirpex-2_1.png"},{"@type":"BreadcrumbList","@id":"https:\/\/computaex.es\/ciencias-de-la-vida\/#breadcrumb","itemListElement":[{"@type":"ListItem","position":1,"name":"Portada","item":"https:\/\/computaex.es\/"},{"@type":"ListItem","position":2,"name":"Ciencias de la Vida"}]},{"@type":"WebSite","@id":"https:\/\/computaex.es\/#website","url":"https:\/\/computaex.es\/","name":"COMPUTAEX Foundation","description":"COMPUTAEX","publisher":{"@id":"https:\/\/computaex.es\/#organization"},"potentialAction":[{"@type":"SearchAction","target":{"@type":"EntryPoint","urlTemplate":"https:\/\/computaex.es\/?s={search_term_string}"},"query-input":{"@type":"PropertyValueSpecification","valueRequired":true,"valueName":"search_term_string"}}],"inLanguage":"en-US"},{"@type":"Organization","@id":"https:\/\/computaex.es\/#organization","name":"COMPUTAEX","url":"https:\/\/computaex.es\/","logo":{"@type":"ImageObject","inLanguage":"en-US","@id":"https:\/\/computaex.es\/#\/schema\/logo\/image\/","url":"https:\/\/computaex.es\/wp-content\/uploads\/2025\/05\/cropped-COMPUTAEX_transparente-scaled-1.png","contentUrl":"https:\/\/computaex.es\/wp-content\/uploads\/2025\/05\/cropped-COMPUTAEX_transparente-scaled-1.png","width":2560,"height":970,"caption":"COMPUTAEX"},"image":{"@id":"https:\/\/computaex.es\/#\/schema\/logo\/image\/"},"sameAs":["https:\/\/m.facebook.com\/computaex\/","https:\/\/x.com\/computaex","https:\/\/es.linkedin.com\/company\/cenits"]}]}},"_links":{"self":[{"href":"https:\/\/computaex.es\/en\/wp-json\/wp\/v2\/pages\/3769","targetHints":{"allow":["GET"]}}],"collection":[{"href":"https:\/\/computaex.es\/en\/wp-json\/wp\/v2\/pages"}],"about":[{"href":"https:\/\/computaex.es\/en\/wp-json\/wp\/v2\/types\/page"}],"author":[{"embeddable":true,"href":"https:\/\/computaex.es\/en\/wp-json\/wp\/v2\/users\/1"}],"replies":[{"embeddable":true,"href":"https:\/\/computaex.es\/en\/wp-json\/wp\/v2\/comments?post=3769"}],"version-history":[{"count":11,"href":"https:\/\/computaex.es\/en\/wp-json\/wp\/v2\/pages\/3769\/revisions"}],"predecessor-version":[{"id":8149,"href":"https:\/\/computaex.es\/en\/wp-json\/wp\/v2\/pages\/3769\/revisions\/8149"}],"wp:attachment":[{"href":"https:\/\/computaex.es\/en\/wp-json\/wp\/v2\/media?parent=3769"}],"wp:term":[{"taxonomy":"category","embeddable":true,"href":"https:\/\/computaex.es\/en\/wp-json\/wp\/v2\/categories?post=3769"},{"taxonomy":"post_tag","embeddable":true,"href":"https:\/\/computaex.es\/en\/wp-json\/wp\/v2\/tags?post=3769"}],"curies":[{"name":"wp","href":"https:\/\/api.w.org\/{rel}","templated":true}]}}