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: Carbon oxygenate transformations by actinide compounds and catalysts Year: 2017
Authors (2):
P. L. Arnold, Z. ë R. Turner
Publisher: Nature Reviews Chemistry
DOI: 10.1038/s41570-016-0002 article-journal
Themes: Transformations (2017)
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Title: Operando Generated Ordered Heterogeneous Catalyst for the Selective Conversion of CO2 to Methanol Year: 2021
Authors (11):
A. Cherevotan, J. Raj, L. Dheer, S. Roy, S. Sarkar, R. Das, C. P. Vinod, S. Xu, P. P. Wells, U. V. Waghmare, S. C. Peter
Publisher: ACS Energy Letters
DOI: 10.1021/acsenergylett.0c02614 article-journal
Themes: Collaborations (2021)
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Title: Combining quasielastic neutron scattering and molecular dynamics to study methane motions in ZSM-5 Year: 2022
Authors (9):
A. P. Hawkins, A. Zachariou, I. P. Silverwood, C. Yong, P. Collier, I. Todorov, R. F. Howe, S. F. Parker, D. Lennon
Publisher: The Journal of Chemical Physics Facebook
DOI: 10.1063/5.0123434 journal-article
Themes: Collaborations (2022), Design (2022)
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Title: Recognizing the best catalyst for a reaction Year: 2023
Authors (7):
A. Lazaridou, L. R. Smith, S. Pattisson, N. F. Dummer, J. J. Smit, P. Johnston, G. J. Hutchings
Publisher: Nature Reviews Chemistry
DOI: 10.1038/s41570-023-00470-5 journal-article
Themes: Collaborations (2023), Core (2023)
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