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: Progress towards five dimensional diffraction imaging of functional materials under process conditions Year: 2014
Authors (4):
A. M. Beale, S. D. M. .Jacques, E. K. Gibson, M. Di Michiel
Publisher: Coordination Chemistry Reviews
DOI: 10.1016/j.ccr.2014.05.008 article-journal
Themes: Design (2014)
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Title: Nanoporous carbon/WO3 anodes for an enhanced water photooxidation Year: 2016
Authors (5):
A. Gomis-Berenguer, V. Celorrio, J. Iniesta, D. J. Fermín, C. O. Ania
Publisher: Carbon
DOI: 10.1016/j.carbon.2016.07.045 article-journal
Themes: Energy (2016)
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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: SCILLs as selective catalysts for the oxidation of aromatic alcohols Year: 2019
Authors (8):
P. Goodrich, C. Hardacre, H. G. Manyar, V. I. Parvulescu, O. D. Pavel, I. Podolean, K. Ralphs, S. F. . R. Taylor
Publisher: Catalysis Today
DOI: 10.1016/j.cattod.2018.07.014 article-journal
Themes: Energy (2019)
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Title: In-depth characterisation of metal-support compounds in spent Co/SiO2 Fischer-Tropsch model catalysts Year: 2019
Authors (7):
C. R. A. .Catlow, M. Claeys, N. Fischer, E. K. Gibson, J. H. Neethling, E. J. Olivier, M. Wolf
Publisher: Catalysis Today
DOI: 10.1016/j.cattod.2019.01.065 article-journal
Themes: Collaborations (2019)
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Title: Preparation of bifunctional Au-Pd/TiO2 catalysts and research on methanol liquid phase one-step oxidation to methyl formate Year: 2018
Authors (8):
D. Shi, J. Liu, R. Sun, S. Ji, S. M. Rogers, B. M. Connolly, N. Dimitratos, A. E. H. .Wheatley
Publisher: Catalysis Today
DOI: 10.1016/j.cattod.2018.01.033 article-journal
Themes: Collaborations (2018)
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Title: Preparation of a highly active ternary Cu-Zn-Al oxide methanol synthesis catalyst by supercritical CO2 anti-solvent precipitation Year: 2018
Authors (10):
S. A. Kondrat, P. J. Smith, L. Lu, J. K. Bartley, S. H. Taylor, M. S. Spencer, G. J. Kelly, C. W. Park, C. J. Kiely, G. J. Hutchings
Publisher: Catalysis Today
DOI: 10.1016/j.cattod.2018.03.046 article-journal
Themes: Environment (2018)
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Title: Neutron spectroscopy studies of methanol to hydrocarbons catalysis over ZSM-5 Year: 2020
Authors (5):
A. Zachariou, A. P. Hawkins, S. F. Parker, D. Lennon, R. F. Howe
Publisher: Catalysis Today
DOI: 10.1016/j.cattod.2020.05.030 article-journal
Themes: Design (2020)
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Title: Real-time tomographic diffraction imaging of catalytic membrane reactors for the oxidative coupling of methane Year: 2020
Authors (10):
A. Vamvakeros, D. Matras, S. D. M. .Jacques, M. Di Michiel, V. Middelkoop, P. Cong, S. W. T. .Price, C. L. Bull, P. Senecal, A. M. Beale
Publisher: Catalysis Today
DOI: 10.1016/j.cattod.2020.05.045 article-journal
Themes: BAG (2020), Core (2020)
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