Mapping the Binding Hot Spots on Human Programmed Cell Death 1 and Its Ligand with Free-Energy Simulations. - Hanjing Ding; Hui Liu (J. Chem. Inf. Model., 2019)

MDBuilder: a PyMOL plugin for the preparation of molecular dynamics simulations. - Hui Liu; Ye Jin; Hanjing Ding (Briefings Bioinform., 2023)