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Structure/Response Correlations and Similarity/Diversity Analysis by GETAWAY Descriptors, 2. Application of the Novel 3D Molecular Descriptors to QSAR/QSPR Studies.

Viviana ConsonniRoberto TodeschiniManuela PavanPaola Gramatica
Published in: J. Chem. Inf. Comput. Sci. (2002)
Keyphrases
  • drug discovery
  • structural analysis
  • data analysis
  • neural network
  • similarity measure
  • image retrieval
  • evolutionary algorithm
  • keypoints
  • structural information
  • edit distance
  • object retrieval