Re: [AMBER] Replica Exchange

From: Jason Swails <jason.swails.gmail.com>
Date: Tue, 16 Sep 2014 08:31:47 -0400

On Tue, 2014-09-16 at 10:39 +0200, Jacopo Sgrignani wrote:
> Dear All
> I would like to run a RE simulation heating only a part of a protein and
> trying the exchange between replicas only considering this subset of
> residues.
>
> Is it possible with Amber14?

No.

HTH,
Jason

-- 
Jason M. Swails
BioMaPS,
Rutgers University
Postdoctoral Researcher
_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber

Received on Tue Sep 16 2014 - 05:30:02 PDT