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Methodology Computational analysis Ligands and receptor crystal structure collection Three-dimensional (3D) structure of selected flavonoids, viz., cyanidin-3- O -glucoside (C3G) (CID: 441667), ()-epicatechin (EC) (CID: 72276), and (+)-catechin (CH) (CID: 9064), and positive control, i.e., arbutin (CID: 440936), were collected from the PubChem database ( 36