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ADME Evaluation in Drug Discovery. 3. Modeling Blood-Brain Barrier Partitioning Using Simple Molecular Descriptors.
Tingjun Hou
Xiaojie Xu
Published in:
J. Chem. Inf. Comput. Sci. (2003)
Keyphrases
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drug discovery
virtual screening
chemical compounds
drug design
early stage
data mining
pharmaceutical industry
data sets
discovery process
real world
decision trees
data model
data sources
network model
scientific data
systems biology