The entire DEKOIS 2.0 dataset was docked using AutoDock Vina, Glide, GOLD, Hybrid, and rDock using ligands embedded by Corina with TautEnum, LigPrep, and RDKit with TautEnum, resulting in 15 docking runs per protein target and a total of 1215 docking experiments amounting to over 1,506,600 ligands docked. Default docking parameters were used unless specified as follows: AutoDock