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: Waste not, want not: CO2 (re)cycling into block polymers Year: 2019
Authors (5):
S. K. Raman, R. Raja, P. L. Arnold, M. G. Davidson, C. K. Williams
Publisher: Chemical Communications
DOI: 10.1039/c9cc02459j article-journal
Themes: Design (2019), Featured (2019)
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Title: Room temperature methoxylation in zeolite H-ZSM-5: an operando DRIFTS/mass spectrometric study Year: 2018
Authors (4):
S. K. Matam, R. F. Howe, A. Thetford, C. R. A. .Catlow
Publisher: Chemical Communications
DOI: 10.1039/c8cc07444e article-journal
Themes: Design (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: Structural investigations in pure-silica and Al-ZSM-12 with MTEA or TEA cations Year: 2018
Authors (8):
M. Počkaj, A. Meden, N. šA. Zabukovec Logar, M. Rangus, G. Mali, I. Lezcano-González, A. M. Beale, A. Golobič
Publisher: Microporous and Mesoporous Materials
DOI: 10.1016/j.micromeso.2017.12.015 article-journal
Themes: Design (2018)
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Title: Electrochemical Synthesis of Nanostructured Metal-Doped Titanates and Investigation of Their Activity as Oxygen Evolution Photoanodes Year: 2018
Authors (9):
M. J. Lawrence, V. Celorrio, X. Shi, Q. Wang, A. Yanson, N. J. E. .Adkins, M. Gu, J. Rodríguez-López, P. Rodríguez
Publisher: ACS Applied Energy Materials
DOI: 10.1021/acsaem.8b00873 article-journal
Themes: BAG (2018)
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Title: Computational QM/MM investigation of the adsorption of MTH active species in H-Y and H-ZSM-5 Year: 2019
Authors (4):
S. A. F. .Nastase, A. J. O'Malley, C. R. A. .Catlow, A. J. Logsdail
Publisher: Physical Chemistry Chemical Physics
DOI: 10.1039/c8cp06736h article-journal
Themes: Design (2018)
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Title: Functional and informatics analysis enables glycosyltransferase activity prediction Year: 2018
Authors (10):
M. Yang, C. Fehl, K. V. Lees, E. -K. Lim, W. A. Offen, G. J. Davies, D. J. Bowles, M. G. Davidson, S. J. Roberts, B. G. Davis
Publisher: Nature Chemical Biology
DOI: 10.1038/s41589-018-0154-9 article-journal
Themes: Transformations (2018)
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Title: Pd local structure and size correlations to the activity of Pd/TiO2 for photocatalytic reforming of methanol Year: 2019
Authors (6):
N. Abdullah, H. Bahruji, S. M. Rogers, P. P. Wells, C. R. A. .Catlow, M. Bowker
Publisher: Physical Chemistry Chemical Physics
DOI: 10.1039/c9cp00826h article-journal
Themes: Design (2019), Environment (2019), BAG (2019)
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Title: Catalytic applications of small bite-angle diphosphorus ligands with single-atom linkers Year: 2017
Authors (1):
S. M. Mansell
Publisher: Dalton Transactions
DOI: 10.1039/c7dt03395h article-journal
Themes: Collaborations (2017)
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