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Classification of Compounds with Distinct or Overlapping Multi-Target Activities and Diverse Molecular Mechanisms Using Emerging Chemical Patterns.

Vigneshwaran NamasivayamYe HuJenny BalferJürgen Bajorath
Published in: J. Chem. Inf. Model. (2013)
Keyphrases
  • multi target
  • chemical compounds
  • multi sensor
  • drug discovery
  • decision trees
  • machine learning
  • multiscale
  • feature set
  • computer vision
  • feature extraction
  • high dimensional
  • multi camera