{"id":37715,"date":"1998-01-01T00:00:00","date_gmt":"1998-01-01T00:00:00","guid":{"rendered":"https:\/\/www.deberes.net\/tesis\/sin-categoria\/estudio-teorico-de-los-efectos-del-medio-en-reactividad-quimica-y-catalisis-enzimatica\/"},"modified":"1998-01-01T00:00:00","modified_gmt":"1998-01-01T00:00:00","slug":"estudio-teorico-de-los-efectos-del-medio-en-reactividad-quimica-y-catalisis-enzimatica","status":"publish","type":"post","link":"https:\/\/www.deberes.net\/tesis\/quimica\/estudio-teorico-de-los-efectos-del-medio-en-reactividad-quimica-y-catalisis-enzimatica\/","title":{"rendered":"Estudio teorico de los efectos del medio en reactividad quimica y catalisis enzimatica."},"content":{"rendered":"<h2>Tesis doctoral de <strong> Raquel Castillo Solsona <\/strong><\/h2>\n<p>El trabajo que se presenta en la memoria es el resultado de varios estudios te\u00f3ricos sobre reactividad qu\u00edmica en disoluci\u00f3n y en medios enzim\u00e1ticos. Se hace especial hincapi\u00e9 en el efecto del medio sobre los mecanismos moleculares, comparando los resultados con c\u00e1lculos mecanocu\u00e1nticos llevados a cabo en fase gas. De los resultados se puede deducir la importancia de las interacciones entre el sistema reaccionante y el medio, ya sean interacciones de tipo electrost\u00e1tico o espec\u00edficas a trav\u00e9s de enlaces de hidr\u00f3geno. en la presente tesis doctoral hemos utilizado las m\u00e1s recientes metodolog\u00edas computacionales. En concreto, el efecto del medio ha sido tratado tanto con modelos continuos como con modelos discretos en los que se combina la mec\u00e1nica cl\u00e1sica y la mec\u00e1nica cu\u00e1ntica.  los estudios realizados versan sobre el mecanismo molecular de la reacci\u00f3n de reimer-tiemann, el proceso de apertura del anillo de ciclopropanonas sustitu\u00eddas, el mecanismo molecular de la transposici\u00f3n de favorskii y la transferencia de hidruro en el centro activo de la dihidrofolato reductasa. Fruto de estos estudios ha sido la publicaci\u00f3n de 7 trabajos en revistas internacionales de investigaci\u00f3n, que figuran adjuntos a la memoria.#<\/p>\n<p>&nbsp;<\/p>\n<h3>Datos acad\u00e9micos de la tesis doctoral \u00ab<strong>Estudio teorico de los efectos del medio en reactividad quimica y catalisis enzimatica.<\/strong>\u00ab<\/h3>\n<ul>\n<li><strong>T\u00edtulo de la tesis:<\/strong>\u00a0 Estudio teorico de los efectos del medio en reactividad quimica y catalisis enzimatica. <\/li>\n<li><strong>Autor:<\/strong>\u00a0 Raquel Castillo Solsona <\/li>\n<li><strong>Universidad:<\/strong>\u00a0 Jaume i de castell\u00f3n<\/li>\n<li><strong>Fecha de lectura de la tesis:<\/strong>\u00a0 01\/01\/1998<\/li>\n<\/ul>\n<p>&nbsp;<\/p>\n<h3>Direcci\u00f3n y tribunal<\/h3>\n<ul>\n<li><strong>Director de la tesis<\/strong>\n<ul>\n<li>Vicent Moliner Iba\u00f1ez<\/li>\n<\/ul>\n<\/li>\n<li><strong>Tribunal<\/strong>\n<ul>\n<li>Presidente del tribunal: Manuel felipe Ruiz l\u00f3pez <\/li>\n<li> Tu\u00f1on garcia de vicu\u00f1a ignacio (vocal)<\/li>\n<li>stanislav Bohm (vocal)<\/li>\n<li>martin Field (vocal)<\/li>\n<\/ul>\n<\/li>\n<\/ul>\n<p>&nbsp;<\/p>\n","protected":false},"excerpt":{"rendered":"<p>Tesis doctoral de Raquel Castillo Solsona El trabajo que se presenta en la memoria es el resultado de varios estudios [&hellip;]<\/p>\n","protected":false},"author":1,"featured_media":0,"comment_status":"open","ping_status":"open","sticky":false,"template":"","format":"standard","meta":{"site-sidebar-layout":"default","site-content-layout":"","ast-site-content-layout":"","site-content-style":"default","site-sidebar-style":"default","ast-global-header-display":"","ast-banner-title-visibility":"","ast-main-header-display":"","ast-hfb-above-header-display":"","ast-hfb-below-header-display":"","ast-hfb-mobile-header-display":"","site-post-title":"","ast-breadcrumbs-content":"","ast-featured-img":"","footer-sml-layout":"","theme-transparent-header-meta":"","adv-header-id-meta":"","stick-header-meta":"","header-above-stick-meta":"","header-main-stick-meta":"","header-below-stick-meta":"","astra-migrate-meta-layouts":"default","ast-page-background-enabled":"default","ast-page-background-meta":{"desktop":{"background-color":"var(--ast-global-color-4)","background-image":"","background-repeat":"repeat","background-position":"center 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