Table 1.
Simulation type | ΔRMSD/0.5 ns |
---|---|
Bulk water under 0 atm in vacuum, waters fixed | 0.389 |
Hydration water under 0 atm in vacuum, waters fixed | 0.032 |
Bulk water under 0 atm in vacuum | 4.841 |
Bulk water under 0 atm in water | 7.548 |
Hydration water under 0 atm in vacuum | 4.263 |
Hydration water under 0 atm in water | 3.861 |