[gmx-users] Protein potential energy

Ming Tang m21.tang at qut.edu.au
Mon Jun 18 10:15:32 CEST 2018

Dear list,

I pulled a protein in water. In order to get the trend of the potential energy terms of the protein, I defined energygrps and reran the system. May I ask can I get the right trend of the protein potential energy terms using this approach?

Your help is appreciated.

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