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Kernel-Based Partial Least Squares: Application to Fingerprint-Based QSAR with Model Visualization.

Yuling AnWoody ShermanSteven L. Dixon
Published in: J. Chem. Inf. Model. (2013)
Keyphrases
  • partial least squares
  • machine learning
  • support vector
  • data sets
  • neural network
  • maximum likelihood
  • dimension reduction
  • neural network model
  • prediction model
  • structural model
  • structural equation modeling