On 6/02/2012 8:28 PM, Anushree Tripathi wrote:
Inspite of having DPPC in index file,when I run the command ( i.e.,
grompp -f nvt.mdp -c em.gro -p topol.top -o nvt.tpr ),I am getting the
error:
Group DPPC 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.
Now, what to do? Please guide me.
You seem not to have used the -n option. You could try using it. :)
Mark
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