Table 4 The parameters of the distributions of ΔΔΔGel calculated for homo-complexes.
From: On the electrostatic component of protein-protein binding free energy
| Amber-Charmm | Amber-OPLS | Charmm-OPLS | |
|---|---|---|---|
| Min | -226.8 (-274.9) | -644.7 (-673.3) | -300.1 (-327.5) |
| Max | 262.3 (166.4) | 572.8 (438.8) | 329.1 (269.4) |
| Mean | 15.3 (-2.63) | -30.9 (-15.2) | 2.6 (4.8) |
| Median | 9.5 (-2.12) | -28.1 (-13.6) | 0.7 (1.6) |
| RMS | 32.6 (30.7) | 70.4 (63.6) | 27.7 (21.8) |
| Variance | 829 (940) | 4003 (3267) | 768 (871) |
| R | 0.92 (0.93) | 0.78 (0.85) | 0.96 (0.95) |
| slope | 0.85 (0.81) | 0.88 (0.89) | 0.94 (0.93) |