[gmx-users] g_potential

ansuman at physics.iisc.ernet.in ansuman at physics.iisc.ernet.in
Thu Apr 4 09:22:53 CEST 2013

Dear Gromacs users,

a)I wish to probe the change in electrostatic potential around a residue/
a group of residues throughout the trajectory. Will the g_potential output
be reliable in this regard?

b) Is there any way available to probe the change in energy associated
with a residue upon the change in conformation(phi/psi)?


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