Browsing by Author "XX648620"
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Santos Vargas, Juan; Fuentealba Rosas, Patricio (2007)The electronic structure and properties of a silabenzene series have been studied using a bifurcation analysis of the sigma and pi separated new electron localization functions, ELF. In all studied molecules a strong pi ...
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Alzate Morales, Jans; Tiznado Vásquez, William; Santos Vargas, Juan; Cárdenas Valencia, Carlos; Contreras Ramos, Renato (2007)We report a theoretical study on a series of CDK2 inhibitors using a set of global reactivity indices defined in terms of the density of states. The statistical analysis was performed on the basis of two groups of 11 and ...