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Licensee MDPI, Basel, Switzerland. This article is an open access article distributed under the terms and conditions of the Creative Commons Attribution (CC BY) license (http://creativecommons.org/licenses/by/4.0/).
ΔRMSD comparison of AutoDock Vina and CS. Blue bars indicate cases in which the top scoring pose identified by CS is closer to the co-crystallized ligand than the one identified by AutoDock Vina. Red bars indicate the opposite cases.