[gmx-users] Plotting Energies versus time

Justin A. Lemkul jalemkul at vt.edu
Fri Jun 18 15:53:33 CEST 2010

Rabab Toubar wrote:
> Hi,
> I want to extract the values for potential E, kinetic E, total E, and temperature from the log file so as to plot them versus time. In NAMD it is easy to do that using cat |grep, is there a similar way to do it in GMX

That's what g_energy is for.


> Thanks
> Rabab Toubar


Justin A. Lemkul
Ph.D. Candidate
ICTAS Doctoral Scholar
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080


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