Implementation of docking, molecular dynamics and free energy to investigate drug potency of novel BCR-ABLT315I inhibitors as an alternative to ponatinib

Autor: Mahmoudi Gomari, Mohammad, Rostami, Neda, Ghodrati, Atefe, Hernandez, Yaeren, Fadaie, Mahmood, Sadegh Eslami, Seyed, Tarighi, Parastoo
Zdroj: In Computational Toxicology November 2021 20
Databáze: ScienceDirect