[gmx-users] grompp help

Charles Li licharles35 at gmail.com
Fri Sep 26 21:08:52 CEST 2014


On this page, you see:
An .mdp file is normally used to run energy minimization or an MD
simulation, but in this case is simply used to generate an atomic
description of the system. An example .mdp file (the one we will use) can
be downloaded here
<http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin/gmx-tutorials/lysozyme_old/Files/ions.mdp>
.

Charles Li

On Fri, Sep 26, 2014 at 12:23 PM, Yaser Hosseini <
yaser.hosseini.biologist at gmail.com> wrote:

> hi gromacs user
>
> i have problem with grompp command in gromacs i cant find .mdp files
> and i cant pass step 4 in this tutorial:
>
>
> http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin/gmx-tutorials/lysozyme_old/04_ions.html
>
> im new in gromacs please help me to find a way to fix my problems.
>
> thank you.
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