SIME: synthetic insight-based macrolide enumerator to generate the V1B library of 1 billion macrolides

We report on a new cheminformatics enumeration technology—SIME, synthetic insight-based macrolide enumerator—a new and improved software technology. SIME can enumerate fully assembled macrolides with synthetic feasibility by utilizing the constitutional and structural knowledge extracted from biosyn...

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Detalles Bibliográficos
Autores principales: Zin, Phyo Phyo Kyaw, Williams, Gavin, Fourches, Denis
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Springer International Publishing 2020
Materias:
Research Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7146965/
https://www.ncbi.nlm.nih.gov/pubmed/33431002
http://dx.doi.org/10.1186/s13321-020-00427-6

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7146965/
https://www.ncbi.nlm.nih.gov/pubmed/33431002
http://dx.doi.org/10.1186/s13321-020-00427-6

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