AMBER: help... structure factors from amber trajectories?

From: Jose Borreguero <borreguero.gmail.com>
Date: Thu, 4 Sep 2008 13:35:57 -0400

Dear Amber users,
I need to compute the incoherent structure factors (elastic, inelastic and
quasi-elastic) for the hydrogen atoms of an amber trajectory. I wonder if
anybody has already gone through the task and would be kind to help me.
Best regards, 
-- 
Dr. Jose M. Borreguero
Postdoctoral Associate
Oak Ridge National Laboratory
P.O. Box 2008, M.S. 6164
Oak Ridge, TN 37831
phone: 865-241-3071 fax: 865-576-5491
Email: borreguerojm.ornl.gov
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Received on Sun Sep 07 2008 - 06:07:31 PDT
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