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. 2022 Dec 8;36:101147. doi: 10.1016/j.imu.2022.101147

Table 7.

Binding free energy (MM-PBSA) calculations for 6NUR-Bexarotene.

van der Waal energy −115.280±0.302 kJ/mol
Electrostattic energy −6.488±0.312 kJ/mol
Polar solvation energy 46.747±0.352 kJ/mol
SASA energy −14.616±0.033 kJ/mol
SAV energy 0.000±0.000 kJ/mol
WCA energy 0.000±0.000 kJ/mol
Binding energy −89.635±0.295 kJ/mol