[gmx-users] NVT equilibration - error message

Balasubramanian Suriyanarayanan bsnsuri at gmail.com
Mon Jun 9 13:59:09 CEST 2014


Thanks for your reply.

when I create index file by grouping sol and ions, protein , ligand and
lipid it  works. But the next error message was "Group SOL_CL not found in
indexfile.
Maybe you have non-default goups in your .mdp file, while not using the
'-n' option of grompp.
In that case use the '-n' option"
But I have really used "-n" option.

please clarify

regards

Suriyanrayanan


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