Machine intelligence for chemical reaction space

Discovering new reactions, optimizing their performance, and extending the synthetically accessible chemical space are critical drivers for major technological advances and more sustainable processes. The current wave of machine intelligence is revolutionizing all data‐rich disciplines. Machine inte...

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Veröffentlicht in:	Wiley interdisciplinary reviews. Computational molecular science Jg. 12; H. 5; S. e1604 - n/a
Hauptverfasser:	Schwaller, Philippe, Vaucher, Alain C., Laplaza, Ruben, Bunne, Charlotte, Krause, Andreas, Corminboeuf, Clemence, Laino, Teodoro
Format:	Journal Article
Sprache:	Englisch
Veröffentlicht:	Hoboken, USA Wiley Periodicals, Inc 01.09.2022 Wiley Subscription Services, Inc
Schlagworte:	Algorithms Artificial intelligence Catalysts Chemical reactions Chemical synthesis computer‐assisted synthesis planning Data science data‐driven approaches Design optimization machine intelligence Machine learning Pharmaceutical industry Space exploration
ISSN:	1759-0876, 1759-0884
Online-Zugang:	Volltext
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