MACAW: An Accessible Tool for Molecular Embedding and Inverse Molecular Design

[Image: see text] The growing capabilities of synthetic biology and organic chemistry demand tools to guide syntheses toward useful molecules. Here, we present Molecular AutoenCoding Auto-Workaround (MACAW), a tool that uses a novel approach to generate molecules predicted to meet a desired property...

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Detalles Bibliográficos
Autores principales: Blay, Vincent, Radivojevic, Tijana, Allen, Jonathan E., Hudson, Corey M., Garcia Martin, Hector
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2022
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9364320/
https://www.ncbi.nlm.nih.gov/pubmed/35857932
http://dx.doi.org/10.1021/acs.jcim.2c00229

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9364320/
https://www.ncbi.nlm.nih.gov/pubmed/35857932
http://dx.doi.org/10.1021/acs.jcim.2c00229

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