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Supervised Self-Organizing Maps in Drug Discovery. 1. Robust Behavior with Overdetermined Data Sets.
Yun-De Xiao
Aaron Clauset
Rebecca Harris
Ersin Bayram
Peter Santago II
Jeffrey D. Schmitt
Published in:
J. Chem. Inf. Model. (2005)
Keyphrases
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self organizing maps
drug discovery
data sets
unsupervised learning
input data
neural network
k means
neural gas
database systems
training set
semi supervised
database
machine learning
early stage
virtual screening
training data
high throughput
biological systems
systems biology
pharmaceutical industry