Evaluation of novel Anti-SARS-CoV-2 compounds by targeting nucleoprotein and envelope protein through homology modeling, docking simulations, ADMET, and molecular dynamic simulations with the MM/GBSA calculation

Autor: Edache, Emmanuel Israel, Uzairu, Adamu, Mamza, Paul Andrew, Shallangwa, Gideon Adamu, Ibrahim, Muhammad Tukur
Zdroj: In Intelligent Pharmacy June 2024 2(3):346-366
Databáze: ScienceDirect