Re: AMBER: center of mass dihedral restraints

From: Carlos Simmerling <carlos.csb.sunysb.edu>
Date: Mon, 25 Sep 2006 07:43:49 -0400

Lauren,
we have some code that we've just developed for this and it's not
yet user-friendly. It might work for you, but it depends a bit
on how big your groups are, etc. Can you give me any info
on what you need to do?
carlos

Lauren O'Neil wrote:

> A quick question:
>
> Is it possible to setup a center of mass dihedral restraint in amber?
> I know that this can be done for distances. I searched the archive of
> the reflector and there was an unanswered message from 2002 on this
> topic.
> Thanks for the help...
>
> Lauren O'Neil
> University of Notre Dame
> Notre Dame, IN
>
> -----------------------------------------------------------------------
> The AMBER Mail Reflector
> To post, send mail to amber.scripps.edu
> To unsubscribe, send "unsubscribe amber" to majordomo.scripps.edu

-----------------------------------------------------------------------
The AMBER Mail Reflector
To post, send mail to amber.scripps.edu
To unsubscribe, send "unsubscribe amber" to majordomo.scripps.edu
Received on Wed Sep 27 2006 - 06:07:11 PDT
Custom Search