[gmx-users] potential energy of only the protein
sarbani_c84 at rediffmail.com
Tue Oct 30 11:46:37 CET 2007
I want to get the potential energy of only the protein ie. without that of the
water.'g_energy' calculates the energy from the energy file. The groups written for the
"energygroups" are 'protein sol'.
Is there any way to get the energy only of the protein?
Thanks in advance.
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