[gmx-users] Running no periodic boundary condition simulation in GROMACS
mark.j.abraham at gmail.com
Sun Oct 15 21:55:11 CEST 2017
See e.g. http://www.gromacs.org/Documentation/How-tos/Single-Point_Energy but
I think that as you have phrased it, your objective may not help find out
On Sun, Oct 15, 2017 at 12:32 PM sanjeet kumar singh ch16d012 <
ch16d012 at smail.iitm.ac.in> wrote:
> Dear all,
> I want to run no pbc simulation for a single chain in GROMACS
> inorder to find out the forcefield applied potential energy of the chain.
> Can anyone please tell me how to do it?
> Thanks in advance
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