[gmx-users] apply force on single molecule

Smith, Micholas D. smithmd at ornl.gov
Tue Mar 8 20:30:02 CET 2016

Yes. Take a look at the manual for information on using the Pulling code.

Micholas Dean Smith, PhD.
Post-doctoral Research Associate
University of Tennessee/Oak Ridge National Laboratory
Center for Molecular Biophysics

From: gromacs.org_gmx-users-bounces at maillist.sys.kth.se <gromacs.org_gmx-users-bounces at maillist.sys.kth.se> on behalf of Parvez Mh <parvezmh89 at gmail.com>
Sent: Tuesday, March 08, 2016 2:20 PM
To: gromacs.org_gmx-users at maillist.sys.kth.se
Subject: [gmx-users] apply force on single molecule

Dear all,

I want look at change in potential energy profile, when i apply force on a
molecule on one end where other end fixed in a position. Is it possible do
it in gromacs. If yes, how may i proceed?

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