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Toward a Comprehensive Treatment of Tautomerism in Chemoinformatics Including in InChI V2.

Devendra K. DhakedWolf-Dietrich IhlenfeldtHitesh PatelVictorien DelannéeMarc C. Nicklaus
Published in: J. Chem. Inf. Model. (2020)
Keyphrases
  • computational methods
  • systems biology
  • database
  • artificial intelligence
  • search engine
  • three dimensional
  • expert systems
  • virtual screening