Re: [AMBER] remd exchange acceptance

From: Adrian Roitberg <roitberg.ufl.edu>
Date: Thu, 28 Feb 2013 07:37:40 -0500

that data should be in the remlog file

adrian

On 2/28/13 1:08 AM, Kim Hyunsik wrote:
> Dear experts,
>
> hello
>
> This is a amber beginner to run replica exchange molecular dynamics.
>
> After the calculating, how can I get average exchange acceptances of each replicas?
>
>
> Thank you
>
> Sincerely yours,
> Kim.
> _______________________________________________
> AMBER mailing list
> AMBER.ambermd.org
> http://lists.ambermd.org/mailman/listinfo/amber

-- 
                            Dr. Adrian E. Roitberg
                                  Professor
                Quantum Theory Project, Department of Chemistry
                            University of Florida
                              roitberg.ufl.edu
_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber
Received on Thu Feb 28 2013 - 05:00:08 PST
Custom Search