EHreact: Extended Hasse Diagrams for the Extraction and Scoring of Enzymatic Reaction Templates

[Image: see text] Data-driven computer-aided synthesis planning utilizing organic or biocatalyzed reactions from large databases has gained increasing interest in the last decade, sparking the development of numerous tools to extract, apply, and score general reaction templates. The generation of re...

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Detalles Bibliográficos
Autores principales: Heid, Esther, Goldman, Samuel, Sankaranarayanan, Karthik, Coley, Connor W., Flamm, Christoph, Green, William H.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2021
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8549070/
https://www.ncbi.nlm.nih.gov/pubmed/34587449
http://dx.doi.org/10.1021/acs.jcim.1c00921

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8549070/
https://www.ncbi.nlm.nih.gov/pubmed/34587449
http://dx.doi.org/10.1021/acs.jcim.1c00921

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