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De Novo Molecular Design by Combining Deep Autoencoder Recurrent Neural Networks with Generative Topographic Mapping.

Boris SattarovIgor I. BaskinDragos HorvathGilles MarcouEsben Jannik BjerrumAlexandre Varnek
Published in: J. Chem. Inf. Model. (2019)
Keyphrases
  • recurrent neural networks
  • echo state networks
  • neural network
  • pattern recognition
  • feature extraction
  • dimension reduction
  • feedforward neural networks
  • recurrent networks