Identification of novel discoidin domain receptor 1 (DDR1) inhibitors using E-pharmacophore modeling, structure-based virtual screening, molecular dynamics simulation and MM-GBSA approaches

Autor: Nada, Hossam, Lee, Kyeong, Gotina, Lizaveta, Pae, Ae Nim, Elkamhawy, Ahmed
Zdroj: In Computers in Biology and Medicine March 2022 142
Databáze: ScienceDirect