[gmx-users] editconf.

Carsten Kutzner ckutzne at gwdg.de
Mon Dec 21 18:13:45 CET 2009


On Dec 21, 2009, at 5:26 PM, <david.lisgarten at canterbury.ac.uk> <david.lisgarten at canterbury.ac.uk> wrote:

> Dear Users,
> 
> 
> 
> Re Introductory tutorial;
> 
> 
> 
> Trying to run the following:
> 
> editconf -f out.gro -o fws_ctr.gro -center x/2 y/2 z/2
You have to give real coordinates for the center, not
in terms of x, y, z. The coordinates are given e.g. at
the end of the gro file.

Carsten





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