question on the wrapping algorithm in NAMD

From: Hyonseok Hwang (danggi_at_northwestern.edu)
Date: Thu May 27 2004 - 18:18:26 CDT

Dear all,

Now I have a DCD file where molecules are wrapped. I would like to know
  what kind of algorithm is used for the wrapping. For example, is the
molecule wrapped if the center of mass of the molecule passes the
boundary of the box?
Thank you very much.

-Hyon

This archive was generated by hypermail 2.1.6 : Wed Feb 29 2012 - 15:37:38 CST