Title: Rapid Estimation of Catalytic Efficiency by Cumulative Atomic Multipole Moments: Application to Ketosteroid Isomerase Mutants

Authors (4): W. Beker, M. W. van der Kamp, A. J. Mulholland, W. A. Sokalski

Themes: Biocatalysis (2017)

DOI: 10.1021/acs.jctc.6b01131

Citations: 9

Pub type: article-journal

Publisher: American Chemical Society (ACS)

Issue: 2

License: http://pubs.acs.org/page/policy/authorchoice_ccby_termsofuse.html

Publication date(s): 2017/02/14 (print) 2017/02/02 (online)

Pages: 945-955

Volume: 13 Issue: 2

Journal: Journal of Chemical Theory and Computation

Link: http://pubs.acs.org/doi/pdf/10.1021/acs.jctc.6b01131

URL: http://dx.doi.org/10.1021/acs.jctc.6b01131

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