Table 2 Binding free energy (KJ/mol) for acarbose and 8c.
Complex | Van der Waals energy | Electrostatic energy | Polar solvation energy | SASAa energy | Binding energy |
---|---|---|---|---|---|
8c | − 166.2 | − 27.3 | 138.0 | − 19.6 | − 75.1 |
Acarbose | − 219.9 | − 30.1 | 163.8 | − 29.5 | − 115.7 |
Complex | Van der Waals energy | Electrostatic energy | Polar solvation energy | SASAa energy | Binding energy |
---|---|---|---|---|---|
8c | − 166.2 | − 27.3 | 138.0 | − 19.6 | − 75.1 |
Acarbose | − 219.9 | − 30.1 | 163.8 | − 29.5 | − 115.7 |