Automated site-directed drug design: searches of the Cambridge Structural Database for bond lengths in molecular fragments to be used for automated structure assembly.
In this paper a database of small frequently occurring molecular fragments is used for the determination of fragment bond lengths from the Cambridge Structural Database. A large number of bond types are described that have not been reported previously.
Chau
P L
PL
Department of Pharmacology, University of Cambridge, U.K.
Dean
P M
PM
D017076:Computer-Aided Design; D016208:Databases, Factual; D015195:Drug Design; D015394:Molecular Structure; D012984:Software