MMGBSA free energy estimate for serotonin binding.
Energy factors | Average | Standard deviation | Std error of mean |
---|---|---|---|
VDWAALS | −28.3725 | 3.65 | 0.10 |
EEL | −73.55 | 28.24 | 0.81 |
EGB | 72.95 | 23.61 | 0.68 |
ESURF | −3.82 | 0.21 | 0.006 |
ΔGgas | −101.9 | 27.60 | 0.80 |
ΔGsolv | 69.12 | 23.60 | 0.68 |
ΔG (total) | −32.80 | 6.05 | 0.17 |