Title: QM/MM simulations identify the determinants of catalytic activity differences between type II dehydroquinase enzymes Year: 2018
Authors (4):
E. Lence, M. W. van der Kamp, C. González-Bello, A. J. Mulholland
Publisher: Organic & Biomolecular Chemistry
DOI: 10.1039/c8ob00066b article-journal
Themes: Biocatalysis (2018)
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Title: Hydrogen generation by photocatalytic reforming of potential biofuels: Polyols, cyclic alcohols, and saccharides Year: 2018
Authors (6):
J. Kennedy, H. Bahruji, M. Bowker, P. R. Davies, E. Bouleghlimat, S. Issarapanacheewin
Publisher: Journal of Photochemistry and Photobiology A: Chemistry
DOI: 10.1016/j.jphotochem.2018.01.031 article-journal
Themes: Energy (2018), Environment (2018)
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Title: Synchrotron Radiation and Catalytic Science Year: 2020
Authors (11):
C. Hardacre, A. M. Beale, E. K. Gibson, J. B. M. .Goodall, A. Goguet, S. A. Kondrat, G. Malta, C. E. Stere, P. P. Wells, G. J. Hutchings, C. R. A. .Catlow
Publisher: Synchrotron Radiation News
DOI: 10.1080/08940886.2020.1701368 article-journal
Themes: Core (2020), Collaborations (2020), Featured (2020)
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Title: Benchmarking quantum mechanical methods for calculating reaction energies of reactions catalyzed by enzymes Year: 2020
Authors (5):
J. Sirirak, N. Lawan, M. W. van der Kamp, J. N. Harvey, A. J. Mulholland
Publisher: PeerJ Physical Chemistry
DOI: 10.7717/peerj-pchem.8 journal-article
Themes: Biocatalysis (2020)
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Title: Catalytic mechanism of the colistin resistance protein MCR-1 Year: 2021
Authors (7):
R. Suardíaz, E. Lythell, P. Hinchliffe, M. W. van der Kamp, J. Spencer, N. Fey, A. J. Mulholland
Publisher: Organic & Biomolecular Chemistry
DOI: 10.1039/d0ob02566f journal-article
Themes: Biocatalysis (2021)
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Title: Rapid Plasma Exsolution from an A‐site Deficient Perovskite Oxide at Room Temperature Year: 2022
Authors (12):
H. Khalid, A. U. Haq, B. Alessi, J. Wu, C. D. Savaniu, K. Kousi, I. S. Metcalfe, S. C. Parker, J. T. S. .Irvine, P. Maguire, E. I. Papaioannou, D. Mariotti
Publisher: Advanced Energy Materials
DOI: 10.1002/aenm.202201131 journal-article
Themes: Circular Economy (2022)
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Title: Computational investigation of the structures and energies of microporous materials Year: 2022
Authors (3):
E. Stacey, M. G. Quesne, C. R. A. .Catlow
Publisher: Elsevier Microporous and Mesoporous Materials
DOI: 10.1016/j.micromeso.2022.112382 journal-article
Themes: New Catalysts (2022)
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Title: Photocatalytic destruction of stearic acid by TiO2 films: Evidence of highly efficient transport of photogenerated electrons and holes Year: 2023
Authors (3):
S. Alofi, C. O'Rourke, A. Mills
Publisher: Journal of Photochemistry and Photobiology A: Chemistry
DOI: 10.1016/j.jphotochem.2022.114273 journal-article
Themes: Water-Energy (2023)
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