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Interpreting Computational Neural Network Quantitative Structure-Activity Relationship Models: A Detailed Interpretation of the Weights and Biases.

Rajarshi GuhaDavid T. StantonPeter C. Jurs
Published in: J. Chem. Inf. Model. (2005)
Keyphrases
  • neural network
  • quantitative structure activity
  • probabilistic model
  • computational models
  • neural network model
  • machine learning
  • preprocessing
  • statistical methods