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De Novo Design of κ-Opioid Receptor Antagonists Using a Generative Deep-Learning Framework.

Leslie Salas-EstradaDavide ProvasiXing QiuHusnu Ümit KaniskanXi-Ping HuangJeffrey F. DibertoJoão Marcelo Lamim RibeiroJian JinBryan L. RothMarta Filizola
Published in: J. Chem. Inf. Model. (2023)
Keyphrases
  • deep learning
  • unsupervised learning
  • probabilistic model
  • data sets
  • machine learning
  • learning algorithm
  • object recognition
  • active learning
  • multi class
  • automatic extraction
  • weakly supervised