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kGCN: a graph-based deep learning framework for chemical structures.

Ryosuke KojimaShoichi IshidaMasateru OhtaHiroaki IwataTeruki HonmaYasushi Okuno
Published in: J. Cheminformatics (2020)
Keyphrases
  • deep learning
  • machine learning
  • probabilistic model
  • pattern recognition
  • object recognition
  • semi supervised
  • graph model