On 5/15/12 11:35 AM, xu zhijun wrote:
Is there the simple method to calculate the center of the mass for a group of 
atoms?
I want to post-process the traj date file.


This is a function of g_traj.

-Justin

--
========================================

Justin A. Lemkul, Ph.D.
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080
http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin

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