Mar 18, 2026·Shengjie Huang, Sijie Yang, Jianqiao Yi +6Molecular Dynamics SimulationParallel Tempering
State Key Laboratory of Bioactive Molecules and Druggability Assessment, International Cooperative Laboratory of Traditional Chinese Medicine Modernization and Innovative Drug Discovery of Chinese Ministry of Education (MOE), School of Pharmacy, Jinan University, #855 Xingye Avenue, Guangzhou, 510632, China · Department of Biochemistry and Molecular Pharmacology, NYU Grossman School of Medicine, New York, NY 10016, USA · Howard Hughes Medical Institute, NYU Grossman School of Medicine, New York, NY 10016, USA +1