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Semiempirical methods do Fukui functions: Unlocking a modeling framework for biosystems.

Igor Barden GrilloGabriel Aires Urquiza-CarvalhoElton José Ferreira ChavesGerd Bruno Rocha
Published in: J. Comput. Chem. (2020)
Keyphrases
  • modeling framework
  • data mining
  • feature space
  • prior knowledge
  • dimensionality reduction