Machine learning classifies catalytic-reaction mechanisms

Danilo M. Lustosa and Anat Milo ()

Nature, 2023, vol. 613, issue 7945, 635-636

Abstract: The study of how chemical reactions work is key to the design of new reactions, but relies on hard work and expert knowledge. A machine-learning tool has been developed that could change the way this challenge is approached.

Keywords: Catalysis; Organic chemistry; Physical chemistry; Chemistry (search for similar items in EconPapers)
Date: 2023
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DOI: 10.1038/d41586-023-00145-7

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