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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Title: Relationship between Mn Oxidation State Changes and Oxygen Reduction Activity in (La,Ca)MnO3 as Probed by In Situ XAS and XES Year: 2021
Authors (8):
V. Celorrio, A. S. Leach, H. Huang, S. Hayama, A. Freeman, D. W. Inwood, D. Fermin, A. E. Russell
Publisher: ACS Catalysis
DOI: 10.1021/acscatal.1c00997 article-journal
Themes: Energy (2021)
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Title: Rigidifying a De Novo Enzyme Increases Activity and Induces a Negative Activation Heat Capacity Year: 2021
Authors (9):
S. A. Hindson, H. A. Bunzel, B. Frank, D. A. Svistunenko, C. Williams, M. W. van der Kamp, A. J. Mulholland, C. R. Pudney, J. L. . R. Anderson
Publisher: ACS Catalysis
DOI: 10.1021/acscatal.1c01776 journal-article
Themes: Circular Economy (2021)
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Title: Spatial Profiling of a Pd/Al2O3 Catalyst during Selective Ammonia Oxidation Year: 2021
Authors (9):
D. Decarolis, A. H. Clark, T. Pellegrinelli, M. Nachtegaal, E. W. Lynch, C. R. A. .Catlow, E. K. Gibson, A. Goguet, P. P. Wells
Publisher: ACS Catalysis
DOI: 10.1021/acscatal.0c05356 article-journal
Themes: New Catalysts (2021)
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Title: Structural basis of terephthalate recognition by solute binding protein TphC Year: 2021
Authors (10):
T. Gautom, D. Dheeman, C. W. Levy, T. Butterfield, G. Alvarez Gonzalez, P. Le Roy, L. Caiger, K. Fisher, L. Johannissen, N. Dixon
Publisher: Nature Communications
DOI: 10.1038/s41467-021-26508-0 journal-article
Themes: Biocatalysis (2021)
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Title: Support and gas environment effects on the preferential oxidation of carbon monoxide over Co3O4 catalysts studied in situ Year: 2021
Authors (8):
T. M. Nyathi, M. I. Fadlalla, N. Fischer, A. P. E. .York, E. J. Olivier, E. K. Gibson, P. P. Wells, M. Claeys
Publisher: Applied Catalysis B: Environmental
DOI: 10.1016/j.apcatb.2021.120450 journal-article
Themes: Core (2021), BAG (2021)
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Title: Ultrarapid Cerium(III)–NHC Catalysts for High Molar Mass Cyclic Polylactide Year: 2021
Authors (6):
R. W. F. .Kerr, P. M. D. . A. .Ewing, S. K. Raman, A. D. Smith, C. K. Williams, P. L. Arnold
Publisher: ACS Catalysis
DOI: 10.1021/acscatal.0c04858 article-journal
Themes: Design (2021)
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Title: Advances in Upgrading Biomass to Biofuels and Oxygenated Fuel Additives Using Metal Oxide Catalysts Year: 2022
Authors (3):
J. Ethiraj, D. P. Wagh, H. G. Manyar
Publisher: Energy & Fuels
DOI: 10.1021/acs.energyfuels.1c03346 journal-article
Themes: Water-Energy (2022)
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Title: High-Ionic-Strength Wastewater Treatment via Catalytic Wet Oxidation over a MnCeOx Catalyst Year: 2022
Authors (8):
X. Ou, H. Daly, X. Fan, S. K. Beaumont, S. Chansai, A. A. Garforth, S. Xu, C. Hardacre
Publisher: ACS Catalysis
DOI: 10.1021/acscatal.2c01952 journal-article
Themes: Water-Energy (2022)
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Title: Multiscale Simulations Identify Origins of Differential Carbapenem Hydrolysis by the OXA-48 β-Lactamase Year: 2022
Authors (5):
V. H. A. .Hirvonen, T. M. Weizmann, A. J. Mulholland, J. Spencer, M. W. van der Kamp
Publisher: ACS Catalysis
DOI: 10.1021/acscatal.1c05694 journal-article
Themes: Biocatalysis (2022)
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