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explicit h-bonding

Brian M Burkhart burkhart at hwi.buffalo.edu
Fri May 2 11:25:36 EST 1997


If the HBONDS flag is turned on, a message is printed telling you that x
many fixed hbonds are used and so many hydrogen bonds found.

How can you, I guess in structure generation fix hydrogen bonds?  In
other words is there something equivalent to the nbfix command
available?


-- 
Brian M Burkhart, Ph.D.
Hauptman-Woodward Medical Research Institute
73 High Street Buffalo, NY 14203
Phone: (716)856-9600 x313  FAX: (716)852-6086



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