Drug-target residence time data

Drug-target residence time data: - residence_time_data.xlsx contains information about target residence time and other binding kinetics coefficients, basic ligand properties like simplified molecular-input line-entry system (SMILES) or International Chemical Identifier (InChI) string, as well as the reference literature in PubMed - structures.zip contains structure files: the protein molecule along with other components such as water molecules and metal ions in the pdb format, while the ligand (drug) in Structure Data Format (sdf) All files can be opened via either a molecular visualization system (eg. PYMOL, Chimera) or a text editor.