[gmx-users] pause a run?
Smith, Micholas D.
smithmd at ornl.gov
Fri Mar 23 15:36:05 CET 2018
If you are writing state files, you can just kill the jobs and use them to restart.
Micholas Dean Smith, PhD. MRSC
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 MD <refmac5 at gmail.com>
Sent: Friday, March 23, 2018 10:33 AM
To: gmx-users at gromacs.org
Subject: [gmx-users] pause a run?
Hi Gromacs Folks,
I was running 6 md runs at the same time (not super fast computer, so it
could take 3 months to complete based on rough estimation). However, I need
to prioritize two runs now but I don't want to just kill the other 4 since
it has been several weeks since I started the runs.
I wonder if there is a way I could "pause" the other 4 runs at this point?
Thanks a bunch,
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