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Connected Subgraph Fingerprints: Representing Molecules Using Exhaustive Subgraph Enumeration.

Louis BellmannPatrick PennerMatthias Rarey
Published in: J. Chem. Inf. Model. (2019)
Keyphrases
  • search space
  • graph mining
  • graph databases
  • np hard
  • subgraph matching
  • neural network
  • maximum matching
  • data sets
  • special case
  • graph data
  • subgraph isomorphism
  • frequent subgraph mining