Skip to main content
. Author manuscript; available in PMC: 2022 Mar 8.
Published in final edited form as: J Chem Inf Model. 2020 Sep 10;60(9):4200–4215. doi: 10.1021/acs.jcim.0c00411

Figure 8:

Figure 8:

Performance of training and testing with and without cross-docked poses. Def2018 models were trained on either the ReDocked2020 set or the CrossDocked2020 set. They were then evaluated on either the ReDocked2020 set, the CrossDocked2020 set, only the cross-docked poses in the CrossDocked2020 set (CDonly), or only the apo receptors of the CDonly set.