On Mon, 29 May 2006 12:14:04 +0530
"Annie Albin" <[EMAIL PROTECTED]> wrote:
Hi all,
I would like to know if there is a way by which we
can get to know
the coordinates of the centre of mass for the
molecule/system?
Since new to this field....any suggestions would
be of great help.
look at g_traj ...
XAvier
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