ChatterjeeLab/MDM2-Peptide-MD-BioEmu

MDM2 (25–109) — molecular dynamics, peptide complexes, and BioEmu features Data for the p53-binding domain of human MDM2, residues 25–109, in the apo form and in complex with peptide ligands, together with features derived from those trajectories. Contents path what it holds md/p53mdm2/ all-atom MD of MDM2(25–109) + peptide complexes md/mdm2_systems/ built systems: topologies, parameters, minimised states md/mdm2_features/ physical interface and… See the full description on the dataset page: https://huggingface.co/datasets/ChatterjeeLab/MDM2-Peptide-MD-BioEmu.