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SYBA: Bayesian estimation of synthetic accessibility of organic compounds
SYBA (SYnthetic Bayesian Accessibility) is a fragment-based method for the rapid classification of organic compounds as easy- (ES) or hard-to-synthesize (HS). It is based on a Bernoulli naïve Bayes classifier that is used to assign SYBA score contributions to individual fragments based on their freq...
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| Publicado no: | J Cheminform |
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| Main Authors: | , , , |
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
Springer International Publishing
2020
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| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC7238540/ https://ncbi.nlm.nih.gov/pubmed/33431015 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1186/s13321-020-00439-2 |
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