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. 2021 Aug 11;136:104758. doi: 10.1016/j.compbiomed.2021.104758

Table 2.

Docking results: Affinity of the best conformation in the binding pocket of SARS-CoV-2 main protease.

Name of molecules Affinity (Kcal/mol) Name of molecules Affinity (Kcal/mol)
1 Gallic acid −5.4 9 Myrtillin −8.2
2 Methyl gallate −5.6 10 Isoquercetin −8.9
3 Agathisflavone −9.0 11 Kaempferol −7.5
4 Sumaflavone −10.7 12 Myricetin −7.7
5 Pentagalloylglucose −9.2 13 Butein −7.2
6 Protocatechuic acid −5.4 14 β-caryophyllene −6.4
7 Hinokiflavone −7.8 15 Artemisinin −7.7
8 Chrysanthemin −8.8 16 Camphor −5.5