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Rationalizing the Activity of an “Artificial Diels-Alderase”: Establishing Efficient and Accurate Protocols for Calculating Supramolecular Catalysis

Journal: Journal of the American Chemical Society

Published: 2019-12-19

DOI: 10.1021/jacs.9b10302

Affiliations: 2

Authors: 5

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Institutions Share
Edinburgh and St Andrews Research School of Chemistry (EaStCHEM), United Kingdom (UK) 0.60
Oxford Chemistry Research Laboratory (CRL), United Kingdom (UK) 0.40