[gmx-users] Potential energy

Ali Alizadeh ali.alizadehmojarad at gmail.com
Sat Dec 28 00:10:15 CET 2013

Dear All users,

I have a question about calculation of potential energy for an especial
group. I know I had to

define an energy group in .mdp file. I forgot to do it. I want to know can
I extract this potential

energy by post processing or not? If not this means I must perform my
simulation again?


Ali Alizadeh

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