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The kernel-weighted local polynomial regression (KwLPR) approach: an efficient, novel tool for development of QSAR/QSAAR toxicity extrapolation models.

Agnieszka Gajewicz-SkretnaSupratik KarMagdalena PiotrowskaJerzy Leszczynski
Published in: J. Cheminformatics (2021)
Keyphrases
  • polynomial regression
  • model selection
  • locally weighted
  • support vector
  • kernel function
  • regression model
  • experimental data
  • learning algorithm
  • prior knowledge
  • linear regression
  • data mining tools
  • drug discovery