On 7/31/13 4:20 PM, Collins Nganou wrote:
Dear all,
I am looking how I can extract the interaction energy between specific
residue in a set of residues.
Nonbonded energy terms are decomposed using energygrps in the .mdp file along
with suitable index groups.
example:
I have DT and D
Dear all,
I am looking how I can extract the interaction energy between specific
residue in a set of residues.
example:
I have DT and DA residues, I would like to plot only the energy of the DT.
I can extract the DT with the index file, But I am missing information on
how to plot the energy b
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