Global reactivity models are impactful in industrial synthesis applications

Artificial Intelligence is revolutionizing many aspects of the pharmaceutical industry. Deep learning models are now routinely applied to guide drug discovery projects leading to faster and improved findings, but there are still many tasks with enormous unrealized potential. One such task is the rea...

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Detalles Bibliográficos
Autores principales: Neves, Paulo, McClure, Kelly, Verhoeven, Jonas, Dyubankova, Natalia, Nugmanov, Ramil, Gedich, Andrey, Menon, Sairam, Shi, Zhicai, Wegner, Jörg K.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Springer International Publishing 2023
Materias:
Research
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9921076/
https://www.ncbi.nlm.nih.gov/pubmed/36774523
http://dx.doi.org/10.1186/s13321-023-00685-0

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9921076/
https://www.ncbi.nlm.nih.gov/pubmed/36774523
http://dx.doi.org/10.1186/s13321-023-00685-0

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