[gmx-users] MD of crystal

Nicolas Bock nbock at lanl.gov
Fri Feb 16 16:12:06 CET 2007


My apologies. Magically things did work now :)

nick


On Fri, 2007-02-16 at 16:07 +0100, David van der Spoel wrote:

> Nicolas Bock wrote:
> > I named it conf.gro since genconf seemed to like that name. Where in the 
> > gromacs manual does it describe the format of a gromos96 file? I only 
> > found references to the gromos96 manual but I couldn't find a file 
> > format description in the online version of it either. Could you point 
> > me to the right place?
> > 
> > nick
> > 
> have you tried naming it conf.g96 ? Then everything should magically work.
> Otherwise chapter 5 should have it.
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