Introduction of Target Cliffs as a Concept To Identify and Describe Complex Molecular Selectivity Patterns.

Ye Hu Jürgen Bajorath

Published in: J. Chem. Inf. Model. (2013)

Keyphrases

data mining
previously unknown
pattern mining
discovering interesting
pattern discovery
real world
neural network
data analysis
high level
three dimensional
complex data
moving target
databases
higher level
complex systems
attribute values
case study
genetic algorithm
drug design