I encountered this error:
Warning: Pressure scaling more than 1%. This may mean your system
is not yet equilibrated. Use of Parrinello-Rahman pressure coupling during
equilibration can lead to simulation instability, and is discouraged.
I saw gromacs explanation to solve this error.
But my question is that, does this error mostly assigned to NPT or prvious steps may bring about this error?
I apperciate your responses in advance,