Masahiko Taguchi, Ryo Oyama, Masahiro Kaneso, Shigehiko Hayashi. Hybrid QM/MM Free-Energy Evaluation of Drug-Resistant Mutational Effect on the Binding of an Inhibitor Indinavir to HIV-1 Protease. Journal of Chemical Information and Computer Sciences, 62(5):1328-1344, 2022. [doi]
Abstract is missing.