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Predicting reaction conditions from limited data through active transfer learning

Transfer and active learning have the potential to accelerate the development of new chemical reactions, using prior data and new experiments to inform models that adapt to the target area of interest. This article shows how specifically tuned machine learning models, based on random forest classifi...

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Detalles Bibliográficos
Autores principales: Shim, Eunjae, Kammeraad, Joshua A., Xu, Ziping, Tewari, Ambuj, Cernak, Tim, Zimmerman, Paul M.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: The Royal Society of Chemistry 2022
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9172577/
https://www.ncbi.nlm.nih.gov/pubmed/35756521
http://dx.doi.org/10.1039/d1sc06932b