Potency Prediction of Covalent Inhibitors against SARS-CoV-2 3CL-like Protease and Multiple Mutants by Multiscale Simulations. - Muya Xiong; Tianqing Nie; Zhewen Li; Meiyi Hu; Haixia Su; Hangchen Hu; Yechun Xu; Qiang Shao (J. Chem. Inf. Model., 2024)