The QM/MM-QTAIM approach reveals the nature of the different reactivity of cephalosporins in the active site of L1 metallo- β-lactamase

New J. Chem., 2019, Advance Article DOI: 10.1039/C9NJ00254E, PaperMaria G. Khrenova, Alexandra V. Krivitskaya, Vladimir G. Tsirelson We combine the QM/MM and the QTAIM approaches to predict the reactivity of cephalosporins in the active site of L1 metallo- β-lactamase. To cite this article before page numbers are assigned, use the DOI form of citation above. The content of this RSS Feed (c) The Royal Society of Chemistry

Source: RSC - New J. Chem. latest articles - April 25, 2019 Category: Chemistry Authors: Maria G. Khrenova Source Type: research