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Improving the performance of models for one-step retrosynthesis through re-ranking.

Min Htoo LinZhengkai TuConnor W. Coley
Published in: J. Cheminformatics (2022)
Keyphrases
  • web search
  • statistical models
  • data mining
  • artificial intelligence
  • bayesian networks
  • probabilistic model
  • ranking algorithm
  • data sets
  • least squares
  • statistical model
  • user feedback
  • autoregressive