Table 3.
The RMSDs chart forall mutations and specific mutationsunder Amber, Charmm and OPLSforce fieldswith 10 dielectric constants model
| Force Field | All Mutations | Asp (D) | Glu (E) | Arg (R) | His (H) | Lys (K) |
|---|---|---|---|---|---|---|
| Amber | 0.86 | 0.31 | 0.64 | 0.63 | 0.16 | 0.90 |
| Charmm | 1.12 | 0.65 | 0.73 | 1.31 | 0.35 | 1.36 |
| OPLS | 1.35 | 1.28 | 0.91 | 1.11 | 0.45 | 1.54 |