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. 2022 Nov 17;10:969559. doi: 10.3389/fchem.2022.969559

TABLE 5.

The binding energy and energy contribution of ligand CM9 inside the active site of MET and FLT4 obtained from MMPBSA analysis in kJ/mol.

Energy (MET) (kJ/mol) Energy (FLT4) (kJ/mol)
Van der Waal energy −285.260 ± 12.278 −252.696 ± 10.873
Electrostattic energy −52.178 ± 9.918 −44.413 ± 11.507
Polar solvation energy 243.885 ± 19.192 191.590 ± 18.692
SASA energy −34.061 ± 2.111 −35.126 ± 2.523
Binding energy −127.614 ± 17.434 −140.645 ± 16.169
CM9 −168.6113 ± 0.7882 −148.4372 ± 0.7555