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. 2020 Sep 13;89:107376. doi: 10.1016/j.compbiolchem.2020.107376

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Fig. 1 — Correlation between the AutoDock Vina docking score and IC₅₀ for 20 known human-USP2 binders. (A) Plot of AD Vina docking score against pIC₅₀. (B) Plot of MMGBSA value (total binding free energy calculated after 5 ns MD simulations) against pIC₅₀.