[gmx-users] table command
Mark Abraham
Mark.Abraham at anu.edu.au
Mon Oct 27 23:48:21 CET 2008
He, Yang wrote:
> Hi all users,
>
> I just use the command mdrun -table table_nonbond.xvg to run the table file but it always shows that
>
> Fatal error:
> Tables in file table_nonbond.xvg not long enough for cut-off:
> should be at least 1.900000 nm
> Actually, I have listed all the values up to 2.000nm in the file so I get a little confused about this error;
>
> Can anyone of you give me some suggestions?
Compare your file with the ones in the distribution in
share/gromacs/top/*xvg, or with those generated with mdrun -debug
without attempting to use your own table.
Mark
More information about the gromacs.org_gmx-users
mailing list