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: Hydrogenation of CO2 to Dimethyl Ether over Brønsted Acidic PdZn Catalysts Year: 2018
Authors (6):
H. Bahruji, R. D. Armstrong, J. Ruiz Esquius, W. Jones, M. Bowker, G. J. Hutchings
Publisher: Industrial & Engineering Chemistry Research
DOI: 10.1021/acs.iecr.8b00230 article-journal
Themes: Environment (2018)
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Title: Accessing Alkyl- and Alkenylcyclopentanes from Cr-Catalyzed Ethylene Oligomerization Using 2-Phosphinophosphinine Ligands Year: 2018
Authors (6):
R. J. Newland, A. Smith, D. M. Smith, N. Fey, M. J. Hanton, S. M. Mansell
Publisher: Organometallics
DOI: 10.1021/acs.organomet.8b00063 article-journal
Themes: Collaborations (2018)
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Title: Rapid Estimation of Catalytic Efficiency by Cumulative Atomic Multipole Moments: Application to Ketosteroid Isomerase Mutants Year: 2017
Authors (4):
W. Beker, M. W. van der Kamp, A. J. Mulholland, W. A. Sokalski
Publisher: Journal of Chemical Theory and Computation
DOI: 10.1021/acs.jctc.6b01131 article-journal
Themes: Biocatalysis (2017)
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Title: Heterostructures of GaN with SiC and ZnO enhance carrier stability and separation in framework semiconductors Year: 2017
Authors (8):
M. R. Farrow, J. Buckeridge, T. Lazauskas, D. Mora-Fonz, D. O. Scanlon, C. R. A. .Catlow, S. M. Woodley, A. A. Sokol
Publisher: Physica Status Solidi (A)
DOI: 10.1002/pssa.201600440 article-journal
Themes: Design (2017)
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Title: Understanding the role of promoters in catalysis: operando XAFS/DRIFTS study of CeOx/Pt/Al2O3 during CO oxidation Year: 2017
Authors (6):
E. K. Gibson, E. M. .Crabb, D. Gianolio, A. E. Russell, D. Thompsett, P. P. Wells
Publisher: Catalysis, Structure & Reactivity
DOI: 10.1080/2055074x.2017.1278890 article-journal
Themes: Design (2017), BAG (2017)
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Title: Photocatalytic hydrogen production by reforming of methanol using Au/TiO2, Ag/TiO2and Au-Ag/TiO2catalysts Year: 2014
Authors (8):
J. Kennedy, W. Jones, D. J. Morgan, M. Bowker, L. Lu, C. J. Kiely, P. P. Wells, N. Dimitratos
Publisher: Catalysis, Structure & Reactivity
DOI: 10.1179/2055075814y.0000000006 article-journal
Themes: Design (2015)
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Title: Selectivity determinants for dual function catalysts: applied to methanol selective oxidation on iron molybdate Year: 2015
Authors (6):
M. Bowker, M. House, A. Alshehri, C. Brookes, E. K. Gibson, P. P. Wells
Publisher: Catalysis, Structure & Reactivity
DOI: 10.1179/2055075815y.0000000002 article-journal
Themes: Design (2015), BAG (2015)
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Title: Reactivity of Boryl- and Silyl-Substituted Carbenoids toward Alkynes: Insertion and Cycloaddition Chemistry Year: 2015
Authors (6):
A. V. Protchenko, M. P. Blake, A. D. Schwarz, C. Jones, P. Mountford, S. Aldridge
Publisher: Organometallics
DOI: 10.1021/om501252m article-journal
Themes: Transformations (2015)
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Title: Chiral Wide-Bite-Angle Diphosphine Ligands: Synthesis, Coordination Chemistry, and Application in Pd-Catalyzed Allylic Alkylation Year: 2015
Authors (7):
C. F. Czauderna, A. G. Jarvis, F. J. L. .Heutz, D. B. Cordes, A. M. Z. .Slawin, J. I. van der Vlugt, P. C. J. .Kamer
Publisher: Organometallics
DOI: 10.1021/om5008055 article-journal
Themes: Environment (2015)
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