[gmx-users] g_energy & graph .xvg
Erik Marklund
erikm at xray.bmc.uu.se
Tue Jun 1 09:59:24 CEST 2010
Carla Jamous skrev:
> Hi everyone,
> please I have a practical question that may sound stupid but I can't
> figure out the answer.
>
> When I run g_energy
> I type the Energies I need, for example:
> 10 (Potential)
> 14 (Kinetic)
> 12 (Total)
>
> My problem is even though I get the averages of the 3 energies on my
> screen, I can't get the three energies on the same graph (.xvg file).
>
> Please does anyone have an idea?
>
> Thank you
> Carla
Try the -nxy option, e.g. xmgrace -nxy myenergydata.xvg
--
-----------------------------------------------
Erik Marklund, PhD student
Dept. of Cell and Molecular Biology, Uppsala University.
Husargatan 3, Box 596, 75124 Uppsala, Sweden
phone: +46 18 471 4537 fax: +46 18 511 755
erikm at xray.bmc.uu.se http://folding.bmc.uu.se/
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