Conformation specification of chemical structures in computer programs.

Andrea L. Fella James G. Nourse Dennis H. Smith

Published in: J. Chem. Inf. Comput. Sci. (1983)

Keyphrases

computer programs
chemical structures
virtual screening
similarity searching
combining multiple clusterings
programming language
binding sites
chemical compounds
high level
turing test
protein structure
expert systems
similarity search
human users
databases
relational data
consensus clustering
software agents