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. Author manuscript; available in PMC: 2020 Nov 25.
Published in final edited form as: J Chem Inf Model. 2019 Oct 31;59(11):4540–4549. doi: 10.1021/acs.jcim.9b00645

Figure 4.

Figure 4.

Scoring performances of ΔvinaXGB, ΔvinaRF20, and Vina on FlexDock. Pearson correlation coefficient for (A) best-scored docking poses and (B) Vina best-scored docking pose in dry environment (Cfd) and water environment (Cfdrw). Here, best-scored poses are determined based on predicted scores. Performances of Vina, ΔvinaRF20, and ΔvinaXGB are colored as blue, green, and orange.