Exhaustive enumeration of molecular substructures.

Richard G. A. Bone Hugo O. Villar

Published in: J. Comput. Chem. (1997)

Keyphrases

exhaustive search
three dimensional
dna computing
data structure
graph mining
brute force
search space
molecular structures
neural network
drug discovery
molecular structure
substructure discovery
dynamic programming
drug design
database systems
virtual screening
van der waals