[gmx-users] box size criterion in high temperature and constant pressure
malaei at ph.iut.ac.ir
Wed Jan 28 13:56:01 CET 2004
Feature of my problem:
There is a peptide and, I want to simulate it in water box. My methode is MD.
At first, The peptide size detrmine the box size (in initialization).
in high temperature(350-400K) and constant pressure, Are there other criterion
for box size?
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