The use of global and local reactivity descriptors of conceptual DFT to describe toxicity of benzoic acid derivatives

Autor: Ramírez-Martínez, Cinthia, Zárate-Hernández, Luis A., Camacho-Mendoza, Rosa L., González-Montiel, Simplicio, Meneses-Viveros, Amilcar, Cruz-Borbolla, Julián
Zdroj: In Computational and Theoretical Chemistry August 2023 1226
Databáze: ScienceDirect