A higher flexibility at the SARS-CoV-2 main protease active site compared to SARS-CoV and its potentialities for new inhibitor virtual screening targeting multi-conformers
与SARS-CoV相比,SARS-CoV-2主蛋白酶活性位点具有更高的灵活性,这使其在针对多构象体的新型抑制剂虚拟筛选方面具有潜力。
期刊:Journal of Biomolecular Structure & Dynamics
影响因子:2.4
doi:10.1080/07391102.2021.1924271
Rocha, Rafael E O; Chaves, Elton J F; Fischer, Pedro H C; Costa, Leon S C; Grillo, Igor Barden; da Cruz, Luiz E G; Guedes, Fabiana C; da Silveira, Carlos H; Scotti, Marcus T; Camargo, Alex D; Machado, Karina S; Werhli, Adriano V; Ferreira, Rafaela S; Rocha, Gerd B; de Lima, Leonardo H F