This script can be used on MacOS and Linux machines to dock multiple ligands to a single receptor using AutoDock Vina. Docking parameters are defined within param.txt and can be expanded to include commands such as exhaustiveness and num_modes.
This script can be used on MacOS and Linux machines to dock multiple ligands to a single receptor using AutoDock Vina. Docking parameters are defined within param.txt and can be expanded to include commands such as exhaustiveness and num_modes.