[gmx-users] force

[Florian Dommert]

* Shuangxing Dai <shuangxingdai at gmail.com> [2009-06-27 18:57:41 -0600]:

> The nstfout =1 in mdout.mdp. So this should not be where the problem is.

So this was the most obvious mistake I could imagine and you see it is
always appreciated that you put your mdp file also to the list, that
everybody knows your input parameters. However in case you already told
gromacs to write out the data to the trr file it should be there.
So if you try:

  echo 0 | g_traj -f traj.trr -s topol.tpr -of 

Only zeros are contained in force.xvg ??

/Flo

>
> ----- Original Message ----- From: "Florian Dommert" 
> <dommert at icp.uni-stuttgart.de>
> To: "Discussion list for GROMACS users" <gmx-users at gromacs.org>
> Sent: Saturday, June 27, 2009 3:20 PM
> Subject: Re: [gmx-users] force
>
>
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-- 
Florian Dommert
Dipl.-Phys.

Institute for Computational Physics
University Stuttgart

Pfaffenwaldring 27
70569 Stuttgart

Tel: +49 - 711 / 6856-3613
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