[gmx-users] error message
Xavier Periole
x.periole at chem.rug.nl
Mon Sep 13 15:36:43 CEST 2004
Maria Sabaye Moghaddam wrote:
>Hi Everyone;
>
> I am getting an error message after running:
>grompp -f name.mdp -p name.top -c name.gro -o name.tpr
>
>as
>processing coordinates...
>Fatal error: number of coordinates in coordinate file (name.gro, 202)
> does not match topology (name.top, 2548)
>
>
you have to check the name.top file and include 2346 atoms that are missing
compared to the name.gro. May be the solvent ??
XAvier
--
----------------------------------------------
Xavier Periole - Ph.D.
Dept. of Biophysical Chemistry / MD Group
Univ. of Groningen
Nijenborgh 4
9747 AG Groningen
The Netherlands
Tel: +31-503634329
Fax: +31-503634800
email: x.periole at chem.rug.nl
web-page: http://md.chem.rug.nl/~periole
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