Title: Rapid Estimation of Catalytic Efficiency by Cumulative Atomic Multipole Moments: Application to Ketosteroid Isomerase Mutants Year: 2017
Authors (4):
W. Beker, M. W. van der Kamp, A. J. Mulholland, W. A. Sokalski
Publisher: Journal of Chemical Theory and Computation
DOI: 10.1021/acs.jctc.6b01131 article-journal
Themes: Biocatalysis (2017)
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Title: Enhancing Hydrogen Evolution Electrocatalytic Performance in Neutral Media via Nitrogen and Iron Phosphide Interactions Year: 2021
Authors (11):
S. Zhao, R. Xie, L. Kang, M. Yang, X. He, W. Li, F. R. Wang, D. J. L. .Brett, G. He, G. Chai, I. P. Parkin
Publisher: Small Science
DOI: 10.1002/smsc.202100032 article-journal
Themes: BAG (2021)
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Title: Teaching Enzyme Catalysis Using Interactive Molecular Dynamics in Virtual Reality Year: 2019
Authors (7):
S. J. Bennie, K. E. Ranaghan, H. M. Deeks, H. E. Goldsmith, M. B. O’Connor, A. J. Mulholland, D. R. Glowacki
Publisher: Journal of Chemical Education
DOI: 10.1021/acs.jchemed.9b00181 journal-article
Themes: Biocatalysis (2019)
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Title: NMR relaxation time measurements of solvent effects in an organocatalysed asymmetric aldol reaction over silica SBA-15 supported proline Year: 2022
Authors (6):
G. Di Carmine, L. Forster, S. Wang, C. M. A. .Parlett, A. Carlone, C. D'Agostino
Publisher: Reaction Chemistry & Engineering
DOI: 10.1039/d1re00471a journal-article
Themes: Core (2022)
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