[gmx-users] Re: how to turn off the interamolecular interaction

Mark Abraham Mark.Abraham at anu.edu.au
Wed Nov 19 09:46:03 CET 2008

xianghong qi wrote:
> Hi, Mark:
> for these two cases
> energygrp_excl           = Methane1 Methane2
> and 
> energygrp_excl           = methane1 methane2
> I got same error: methane1(or Methane1 ) is not energy group.

OK, so now that it's a group, you need it to be an energy group - see 


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