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Surrogate AutoShim: Predocking into a Universal Ensemble Kinase Receptor for Three Dimensional Activity Prediction, Very Quickly, without a Crystal Structure.
Eric J. Martin
David C. Sullivan
Published in:
J. Chem. Inf. Model. (2008)
Keyphrases
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three dimensional
prediction accuracy
ensemble classifier
image sequences
prediction error
data sets
neural network
data mining
learning algorithm
social networks
decision trees
artificial neural networks
support vector machine
hierarchical structure
structural information