Title: Understanding the molecular basis for the controlled design of ruthenium nanoparticles in microporous aluminophosphates Year: 2016
Authors (5):
M. E. Potter, J. M. Purkis, M. Perdjon, P. P. Wells, R. Raja
Publisher: Molecular Systems Design & Engineering
DOI: 10.1039/c6me00061d article-journal
Themes: BAG (2016)
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Title: The highly surprising behaviour of diphosphine ligands in iron-catalysed Negishi cross-coupling Year: 2018
Authors (12):
A. M. Messinis, S. L. J. .Luckham, P. P. Wells, D. Gianolio, E. K. Gibson, H. M. O’Brien, H. A. Sparkes, S. A. Davis, J. Callison, D. Elorriaga, O. Hernandez-Fajardo, R. B. Bedford
Publisher: Nature Catalysis
DOI: 10.1038/s41929-018-0197-z article-journal
Themes: Transformations (2019), BAG (2019)
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Title: Projector-Based Embedding Eliminates Density Functional Dependence for QM/MM Calculations of Reactions in Enzymes and Solution Year: 2019
Authors (8):
S. J. Bennie, N. Lawan, S. J. Macrae, F. R. Manby, A. J. Mulholland, K. E. Ranaghan, D. Shchepanovska, J. Zurek
Publisher: Journal of Chemical Information and Modeling
DOI: 10.1021/acs.jcim.8b00940 article-journal
Themes: Biocatalysis (2019)
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Title: Structural selectivity of supported Pd nanoparticles for catalytic NH3 oxidation resolved using combined operando spectroscopy Year: 2019
Authors (18):
E. K. Dann, E. K. Gibson, R. H. Blackmore, C. R. A. .Catlow, P. Collier, A. Chutia, T. Eralp Erden, C. Hardacre, A. B. Kroner, M. Nachtegaal, A. Raj, S. M. Rogers, S. F. . R. Taylor, P. B. J. .Thompson, G. F. Tierney, C. D. Zeinalipour-Yazdi, A. Goguet, P. P. Wells
Publisher: Nature Catalysis
DOI: 10.1038/s41929-018-0213-3 article-journal
Themes: Design (2019)
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Title: Sustaining metal–organic frameworks for water–gas shift catalysis by non-thermal plasma Year: 2019
Authors (11):
N. Al-Janabi, S. Chansai, X. Fan, A. Goguet, C. Hardacre, B. Inceesungvorn, P. A. Martin, C. E. Stere, S. F. . R. Taylor, K. Wangkawong, S. Xu
Publisher: Nature Catalysis
DOI: 10.1038/s41929-018-0206-2 article-journal
Themes: Energy (2019)
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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: Tuning of catalytic sites in Pt/TiO2 catalysts for the chemoselective hydrogenation of 3-nitrostyrene Year: 2019
Authors (15):
M. Macino, A. J. Barnes, S. M. Althahban, R. Qu, E. K. Gibson, D. J. Morgan, S. J. Freakley, N. Dimitratos, C. J. Kiely, X. Gao, A. M. Beale, D. Bethell, Q. He, M. Sankar, G. J. Hutchings
Publisher: Nature Catalysis
DOI: 10.1038/s41929-019-0334-3 article-journal
Themes: Environment (2019), Transformations (2019)
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Title: Identifying palladium culprits in amine catalysis Year: 2021
Authors (23):
M. ëL. Avanthay, R. B. Bedford, C. S. Begg, D. Böse, J. Clayden, S. A. Davis, J. -C. Eloi, G. P. Goryunov, I. V. Hartung, J. Heeley, K. A. Khaikin, M. O. Kitching, J. Krieger, P. S. Kulyabin, A. J. J. .Lennox, R. Nolla-Saltiel, N. E. Pridmore, B. J. S. .Rowsell, H. A. Sparkes, D. V. Uborsky, A. Z. Voskoboynikov, M. P. Walsh, H. J. Wilkinson
Publisher: Nature Catalysis
DOI: 10.1038/s41929-021-00710-1 journal-article
Themes: Circular Economy (2021)
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Title: LanCLs add glutathione to dehydroamino acids generated at phosphorylated sites in the proteome Year: 2021
Authors (18):
K. -Y. Lai, S. R. G. .Galan, Y. Zeng, T. H. Zhou, C. He, R. Raj, J. Riedl, S. Liu, K. P. Chooi, N. Garg, M. Zeng, L. H. Jones, G. J. Hutchings, S. Mohammed, S. K. Nair, J. Chen, B. G. Davis, W. A. van der Donk
Publisher: Cell
DOI: 10.1016/j.cell.2021.04.001 article-journal
Themes: New Catalysts (2021), Featured (2021)
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Title: Multiscale Workflow for Modeling Ligand Complexes of Zinc Metalloproteins Year: 2021
Authors (8):
Z. Yang, R. M. Twidale, S. Gervasoni, R. Suardíaz, C. K. Colenso, E. J. M. .Lang, J. Spencer, A. J. Mulholland
Publisher: Journal of Chemical Information and Modeling
DOI: 10.1021/acs.jcim.1c01109 journal-article
Themes: Biocatalysis (2021)
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