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Vertex indexes of molecular graphs in structure-activity relationships: a study of the convulsant-anticonvulsant activity of barbiturates and the carcinogenicity of unsubstituted polycyclic aromatic hydrocarbons.

Gilles KlopmanChandan Raychaudhury
Published in: J. Chem. Inf. Comput. Sci. (1990)
Keyphrases
  • activity theory
  • database
  • graph representation
  • data structure
  • human activities
  • directed graph
  • activity patterns