> However, due to the
> circularity, the sum and average of dihedral angles could be tricky.
See
http://en.wikipedia.org/wiki/Directional_statistics
Batschelet, E. Circular statistics in biology, Academic Press, London,
1981. ISBN 0-12-081050-6.
the method from there was implemented in carnal and likely ptraj.
Bill
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Received on Fri Sep 03 2010 - 11:00:06 PDT