Syba: bayesian estimation of synthetic accessibility of organic compounds

HIGHLIGHTS

  • who: Milan Voršilák from the (UNIVERSITY) have published the research: SYBA: Bayesian estimation of synthetic accessibility of organic compounds, in the Journal: (JOURNAL)
  • what: In the present work, SYBA method for the classification of organic compounds as easy- and hard-to-synthesize is described.
  • how: The authors developed SYBA (SYnthetic Bayesian Accessibility) a rapid fragmentbased score derived using Bayesian probabilistic modeling.

SUMMARY

    In the data set SYBA was derived from_(further referred to as the training data set S), ES and HS compounds are represented evenly, the . . .

     

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