[gmx-users] Posre.itp during pre equilibration

statk002 at fiu.edu statk002 at fiu.edu
Mon Mar 22 22:07:01 CET 2004

Hello all,
I am trying to run a simulation of 3 identical protein chains with the same topology file,in a lipid medium.I am having trouble running the preequilibration step.
If I have only one restraining "posre.itp" file for one protein is it sufficient ? Will that file constrain the remaining 2 protein chains during the preequilibration?

Does anyone have any suggestions?
Thanks in advance.

Sujit Tatke
Florida Intl Univ,Miami
Tel : 305-348-7292/7295

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