[gmx-users] Re: how to turn off the interamolecular interaction
xianghong001 at gmail.com
Wed Nov 19 09:36:17 CET 2008
for these two cases
energygrp_excl = Methane1 Methane2
energygrp_excl = methane1 methane2
I got same error: methane1(or Methane1 ) is not energy group.
Thanks so much.
On Wed, Nov 19, 2008 at 3:25 AM, Mark Abraham <Mark.Abraham at anu.edu.au>wrote:
> xianghong qi wrote:
> and index file was makde from command make_ndx, I named the two methanes as
>> methane1 and methane2.
> So what's different above and below? :-)
> energygrp_excl = Methane1 Methane2
> This is why it's important to look at, and report what you *have* done, not
> what you *think* you have done :-) If someone's having a problem doing
> something, then anything filtered through their brain is suspect...
> trouble-shooting is best done with the raw material.
> gmx-users mailing list gmx-users at gromacs.org
> Please search the archive at http://www.gromacs.org/search before posting!
> Please don't post (un)subscribe requests to the list. Use the www interface
> or send it to gmx-users-request at gromacs.org.
> Can't post? Read http://www.gromacs.org/mailing_lists/users.php
Some people make the world more special just by being in it.
-------------- next part --------------
An HTML attachment was scrubbed...
More information about the gromacs.org_gmx-users