[X-plor] TYPE and CHARge of azide
Jonel Saludes
via x-plor%40net.bio.net
(by jpsaludes from ucdavis.edu)
Tue May 20 13:17:31 EST 2008
Dear XPLOR experts:
I am on the learning phase of using XPLOR, and I would like to know
what TYPE and CHARge are assigned to each N atoms in an azide, e.g.
in CH3N3 when writing it's topology file. Right now, I am using the
information found in Engh and Huber (Acta Cryst, A47, 392-400), but I
do not see any values associated with azide. I would appreciate any
help. Thanks.
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