[gmx-users] Pressure Question

[Johnny Lu]

Hi.

If my NVT simulation of a protein in 30k molecules of water has a pressure
of 11 bar (error 0.5 bar from g_energy), will the dynamics (not
distribution of conformations) change enough that the mechanism inferred
from this simulation be significantly more unreliable than the mechanism
inferred from a 1 bar simulation? (Will the reviewers cut my paper into
ribbons?)

Thanks again.