[gmx-users] Error.

karamyog singh karamyog.singh at gmail.com
Wed Jul 5 09:51:04 CEST 2006

I just need to specify energygrps. I used : energygrps = DP  MY

Forget the table look up. If I freeze one group, why is the second not
moving? I am imparting it an initial velocity at some temp. I think this
could be because my second group which I am trying to move is also becoming
frozen for some reason. I do not know this reason.

Any Idea?

Thanks, in the anticipation of a solution. :)

Undergraduate Student,
IIT Kharagpur.

On 7/5/06, Mark Abraham <mark.abraham at anu.edu.au> wrote:
> > Dear Users, Can someone tell me the meaning of this warning.
> >
> > WARNING 1 [file grompp.mdp, line unknown]:
> >   Unknown left-hand energygrp_table in parameter file
> I don't know anything about the energy group table lookup stuff, but this
> error message means that you used an unknown left-hand side to the
> "equations"  in the .mdp file. Usually that means you misspelled it,
> although it looks correct above. Is there another parameter that is
> prerequisite?
> Mark
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