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Small-World Phenomena in Chemical Library Networks: Application to Fragment-Based Drug Discovery.
Naoki Tanaka
Kazuki Ohno
Tatsuya Niimi
Ayako Moritomo
Kenichi Mori
Masaya Orita
Published in:
J. Chem. Inf. Model. (2009)
Keyphrases
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drug discovery
small world
scale free
small world networks
complex networks
chemical compounds
power law
network structure
biological systems
social networks
biological networks
path length
machine learning
virtual screening
pharmaceutical industry
data sets
preferential attachment
early stage
data mining