Title: Quantum Mechanics/Molecular Mechanics Simulations Show Saccharide Distortion is Required for Reaction in Hen Egg‐White Lysozyme Year: 2018
Authors (4):
M. A. L. .Limb, R. Suardíaz, I. M. Grant, A. J. Mulholland
Publisher: Chemistry - A European Journal
DOI: 10.1002/chem.201805250 article-journal
Themes: Biocatalysis (2018)
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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: The Role of Mg(OH)2 in the So-Called “Base-Free” Oxidation of Glycerol with AuPd Catalysts Year: 2018
Authors (8):
J. Fu, Q. He, P. J. Miedziak, G. L. Brett, X. Huang, S. Pattisson, M. Douthwaite, G. J. Hutchings
Publisher: Chemistry - A European Journal
DOI: 10.1002/chem.201704151 article-journal
Themes: Environment (2018)
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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: 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: Mechanism of the Catalytic Carboxylation of Alkylboronates with CO2 Using Ni−NHC Complexes: A DFT Study Year: 2017
Authors (5):
M. Delarmelina, E. Marelli, J. W. de M. Carneiro, S. P. Nolan, M. Bühl
Publisher: Chemistry - A European Journal
DOI: 10.1002/chem.201703567 article-journal
Themes: Energy (2017), Environment (2017)
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Title: Preliminary Investigation on the Electrochemical Activity of Butanol Isomers as Potential Fuel for Direct Alcohol Fuel Cell Year: 2015
Authors (5):
V. K. Puthiyapura, D. J. L. .Brett, A. E. Russell, W. -F. Lin, C. Hardacre
Publisher: ECS Transactions
DOI: 10.1149/06917.0809ecst article-journal
Themes: Energy (2015)
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Title: Di-Zinc-Aryl Complexes: CO2Insertions and Applications in Polymerisation Catalysis Year: 2017
Authors (6):
C. Romain, J. A. Garden, G. Trott, A. Buchard, A. J. P. .White, C. K. Williams
Publisher: Chemistry - A European Journal
DOI: 10.1002/chem.201701013 article-journal
Themes: Transformations (2017)
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Title: Zinc versus Magnesium: Orthogonal Catalyst Reactivity in Selective Polymerizations of Epoxides, Bio-derived Anhydrides and Carbon Dioxide Year: 2017
Authors (4):
P. K. Saini, G. Fiorani, R. T. Mathers, C. K. Williams
Publisher: Chemistry - A European Journal
DOI: 10.1002/chem.201605690 article-journal
Themes: Transformations (2017)
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Title: Designer Titania-Supported Au–Pd Nanoparticles for Efficient Photocatalytic Hydrogen Production Year: 2014
Authors (16):
R. Su, R. Tiruvalam, A. J. Logsdail, Q. He, C. A. Downing, M. T. Jensen, N. Dimitratos, L. Kesavan, P. P. Wells, R. Bechstein, H. H. Jensen, S. Wendt, C. R. A. .Catlow, C. J. Kiely, G. J. Hutchings, F. Besenbacher
Publisher: ACS Nano
DOI: 10.1021/nn500963m article-journal
Themes: Environment (2014)
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