RESEARCH PAPER · Journal of the American Chemical Society · 2026
Boosting Computational Catalysis and Chemical Reactivity with Artificial Intelligence
Konstantinos D. Vogiatzis, Clémence Corminbœuf, Ainara Nova, Kjell Jorner, Johannes Kästner, Markus Meuwly, Philippe Schwaller, Victor Böttcher, Μαρία Δρόσου, Edvin Fako, Hannes Hoppe, Žarko Ivković, Nestor M. Iwanojko, Dimitrios A. Pantazis, Stefan P. Schmid, Kalman Szenes, Auguste Tetenoire, Markus Reiher
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