Mostrando 2 resultados de: 2
Filtros aplicados
Subtipo de publicación
Article(2)
Área temáticas
Ciencias de la computación(1)
Fisiología humana(1)
Química física(1)
Técnicas, equipos y materiales(1)
Computational study of the binding mode, action mechanism and potency of pregabalin through molecular docking and quantum mechanical descriptors
ArticleAbstract: In the present study, we performed a computational study to gain insights on the binding mode and hiPalabras claves:Gabapentin, Molecular docking, Pregabalin, R-pregabalin, Voltage-gated calcium channelsAutores:Belhassan A., Gerli L., Lorena Maribel Meneses-Olmedo, Lorena Meneses, Mendoza-Huizar L.H., Muñoz C. P., Salgado Moran G., Sebastián Cuesta HoyosFuentes:googlescopusInsights on the mechanism, reactivity and selectivity of fructose and tagatose dehydration into 5-hydroxymethylfurfural: A DFT study
ArticleAbstract: In this study, a computational DFT study was performed to propose a new acid catalyzed mechanism toPalabras claves:BIOMASS, Force quantum descriptor, fructose, Tagatose, TautomerizationAutores:Cardona Villada W., Gerli L., Lorena Maribel Meneses-Olmedo, Mendoza-Huizar L.H., Salgado Moran G., Sebastián Cuesta HoyosFuentes:scopus