[AMBER] how to remove the rotational center-of-mass motion ?

From: 张明焜 <zhangmk69.gmail.com>
Date: Fri, 13 Dec 2013 14:30:26 +0800

Hellow specialist:

            I want to remove all the translational and rotational
center-of-mass motion in a MDCRD file.For translational center-of-mass
motion,I konw I can handle it with the command "center" in Ptraj, but is
there any command to deal with the rotational center-of-mass motion in
AMBER ?
        Thanks for your early reply !

-- 
---------------------------------------------------------------------
ZhangMK
+8623-65935648
Chongqing Institute of Green and Intelligent Technology of Chinese Academy
Sciences.
_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber
Received on Thu Dec 12 2013 - 23:00:02 PST
Custom Search