The computer program LUDI: A new method for the de novo design of enzyne inhibitors.

Hans-Joachim Böhm

Published in: J. Comput. Aided Mol. Des. (1992)

Keyphrases

detection method
high accuracy
pairwise
significant improvement
computationally efficient
synthetic data
similarity measure
computational cost
high precision
feature selection
objective function
user interface
cost function
clustering method