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: P450-Catalyzed Regio- and Diastereoselective Steroid Hydroxylation: Efficient Directed Evolution Enabled by Mutability Landscaping Year: 2018
Authors (17):
C. G. Acevedo-Rocha, C. G. Gamble, R. Lonsdale, A. Li, N. Nett, S. Hoebenreich, J. B. Lingnau, C. Wirtz, C. Fares, H. Hinrichs, A. Deege, A. J. Mulholland, Y. Nov, D. Leys, K. J. McLean, A. W. Munro, M. T. Reetz
Publisher: ACS Catalysis
DOI: 10.1021/acscatal.8b00389 article-journal
Themes: Biocatalysis (2018)
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Title: Discovery, Characterization, Engineering, and Applications of Ene-Reductases for Industrial Biocatalysis Year: 2018
Authors (2):
H. S. Toogood, N. S. Scrutton
Publisher: ACS Catalysis
DOI: 10.1021/acscatal.8b00624 article-journal
Themes: Biocatalysis (2018)
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Title: Concurrent Biocatalytic Oxidation and C–C Bond Formation via Gold Catalysis: One-Pot Alkynylation of N-Alkyl Tetrahydroisoquinolines Year: 2018
Authors (3):
M. Odachowski, M. F. Greaney, N. J. Turner
Publisher: ACS Catalysis
DOI: 10.1021/acscatal.8b03169 article-journal
Themes: Biocatalysis (2018)
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Title: Deactivation of a Single-Site Gold-on-Carbon Acetylene Hydrochlorination Catalyst: An X-ray Absorption and Inelastic Neutron Scattering Study Year: 2018
Authors (15):
G. Malta, S. A. Kondrat, S. J. Freakley, C. J. Davies, S. Dawson, X. Liu, L. Lu, K. Dymkowski, F. Fernandez-Alonso, S. Mukhopadhyay, E. K. Gibson, P. P. Wells, S. F. Parker, C. J. Kiely, G. J. Hutchings
Publisher: ACS Catalysis
DOI: 10.1021/acscatal.8b02232 article-journal
Themes: Design (2018), BAG (2018)
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Title: Comparing ammonia diffusion in NH3-SCR zeolite catalysts: a quasielastic neutron scattering and molecular dynamics simulation study Year: 2018
Authors (7):
A. J. O'Malley, M. Sarwar, J. Armstrong, C. R. A. .Catlow, I. P. Silverwood, A. P. E. .York, I. Hitchcock
Publisher: Physical Chemistry Chemical Physics
DOI: 10.1039/c8cp01022f article-journal
Themes: Design (2018)
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Title: QENS study of methane diffusion in Mo/H-ZSM-5 used for the methane dehydroaromatisation reaction Year: 2018
Authors (5):
I. P. Silverwood, M. A. Arán, I. Lezcano-González, A. B. Kroner, A. M. Beale
Publisher: AIP Conference Proceedings
DOI: 10.1063/1.5039294 paper-conference
Themes: Design (2018)
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Title: The adsorption of Cu on the CeO2(110) surface Year: 2017
Authors (8):
A. Chutia, E. K. Gibson, M. R. Farrow, P. P. Wells, D. O. Scanlon, N. Dimitratos, D. J. Willock, C. R. A. .Catlow
Publisher: Physical Chemistry Chemical Physics
DOI: 10.1039/c7cp04144f article-journal
Themes: Design (2017), BAG (2017)
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Title: Tandem Site- and Size-Controlled Pd Nanoparticles for the Directed Hydrogenation of Furfural Year: 2017
Authors (11):
S. M. Rogers, C. R. A. .Catlow, C. E. Chan-Thaw, A. Chutia, N. Jian, R. E. Palmer, M. Perdjon, A. Thetford, N. Dimitratos, A. Villa, P. P. Wells
Publisher: ACS Catalysis
DOI: 10.1021/acscatal.6b03190 article-journal
Themes: Design (2017), BAG (2017)
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Title: Understanding the Role of Molecular Diffusion and Catalytic Selectivity in Liquid-Phase Beckmann Rearrangement Year: 2017
Authors (12):
M. E. Potter, A. J. O'Malley, S. Chapman, J. Kezina, S. H. Newland, I. P. Silverwood, S. Mukhopadhyay, M. Carravetta, T. M. Mezza, S. F. Parker, C. R. A. .Catlow, R. Raja
Publisher: ACS Catalysis
DOI: 10.1021/acscatal.6b03641 article-journal
Themes: Design (2017)
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