[gmx-users] Getting .edr file data as a generic data file

Mark Abraham mark.j.abraham at gmail.com
Fri Jun 7 16:48:27 CEST 2013


On Thu, Jun 6, 2013 at 5:14 PM, Neha <nshafique at wesleyan.edu> wrote:

> Hi again!
>
> At the moment, the only way I know how to access .edr files is through the
> use of g_energy. However g_energy only outputs .xvg files which is fine for
> routine analysis. However if I want to get into further processing, it
> would
> be helpful if I could get the information stored in the .edr files in a
> more
> pliable format.
>

It doesn't get more pliable than the plain text in .xvg! But there are some
ideas here http://www.gromacs.org/Documentation/How-tos/Graphing_Data

Mark


Please let me know if you know how to do this! I am a completely new user to
> Gromacs and appreciate all the help possible.
>
> -Neha
>
>
>
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