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. 2019 Mar 25;19:74. doi: 10.1186/s12906-019-2482-z

Table 3.

Predicted binding energies for constituents present in Cornus capitata docked with α-glucosidase (PDB ID: 3WY1)

S. No. Molecules Binding Energy (kcal/mol) No. of H-bonds Cluster RMSD Reference RMSD
3 Betulinic acid −10.21 0 0.00 25.81
4 Epibetulin −9.06 2 0.00 26.10
1 Arjunolic acid −6.60 2 0.00 26.51
6 Maslinic acid −5.27 3 0.00 24.01
5 Lupeol −4.79 2 0.00 26.16
2 Betulin −4.00 2 0.00 25.71