[AMBER] About the reproducibility of pmemd

From: Val Yu <valyu.mail.nankai.edu.cn>
Date: Mon, 19 May 2014 20:01:48 +0800

I'm using Amber 9. I found that pmemd cannot reproduce orbit from the same
initial conditions, while sander can. Have anyone found the same problem
before?

 

Yu Qinhong

Department of Chemical Biology

Nankai University, Tianjin, China

 

_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber
Received on Mon May 19 2014 - 05:30:02 PDT