Distributed and multicore QuBiLS-MIDAS software v2.0 Computing chiral, fuzzy, weighted and truncated geometrical molecular descriptors based on tensor algebra

von García-Jacas, César R
Veröffentlicht in: Journal of computational chemistry (2020)

Diels-Alder reaction mechanisms of substituted chiral anthracene A theoretical study based on the reaction force and reaction electronic flux

von Hernández Mancera, Jennifer Paola
Veröffentlicht in: Journal of computational chemistry (2020)