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: Hydrogen Oxidation on PdIr/C Catalysts in Alkaline Media Year: 2014
Authors (7):
R. Jervis, N. Mansor, C. Gibbs, C. A. Murray, C. C. Tang, P. R. Shearing, D. J. L. .Brett
Publisher: Journal of The Electrochemical Society
DOI: 10.1149/2.037404jes article-journal
Themes: Energy (2014)
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Title: Sequence Selective Polymerization Catalysis: A New Route to ABA Block Copoly(ester-b-carbonate-b-ester) Year: 2015
Authors (4):
S. Paul, C. Romain, J. Shaw, C. K. Williams
Publisher: Macromolecules
DOI: 10.1021/acs.macromol.5b01293 article-journal
Themes: Transformations (2015)
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Title: Influences of a Dizinc Catalyst and Bifunctional Chain Transfer Agents on the Polymer Architecture in the Ring-Opening Polymerization of ε-Caprolactone Year: 2015
Authors (4):
Y. Zhu, C. Romain, V. Poirier, C. K. Williams
Publisher: Macromolecules
DOI: 10.1021/acs.macromol.5b00225 article-journal
Themes: Transformations (2015)
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Title: Catalysts for the Selective Oxidation of Methanol Year: 2016
Authors (3):
C. Brookes, M. Bowker, P. P. Wells
Publisher: Catalysts
DOI: 10.3390/catal6070092 article-journal
Themes: BAG (2016)
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Title: Strategies for the deposition of LaFeO3 photocathodes: improving the photocurrent with a polymer template Year: 2020
Authors (7):
E. Freeman, S. Kumar, V. Celorrio, M. S. Park, J. H. Kim, D. J. Fermín, S. Eslava
Publisher: Sustainable Energy & Fuels
DOI: 10.1039/c9se01103j article-journal
Themes: Energy (2019)
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Title: Enlighten2: molecular dynamics simulations of protein–ligand systems made accessible Year: 2020
Authors (2):
K. Zinovjev, M. W. van der Kamp
Publisher: Bioinformatics
DOI: 10.1093/bioinformatics/btaa643 article-journal
Themes: Biocatalysis (2020)
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Title: Investigations of Carbon Nitride-Supported Mn3O4 Oxide Nanoparticles for ORR Year: 2020
Authors (8):
A. I. Large, S. Wahl, S. Abate, I. da Silva, J. J. Delgado Jaen, N. Pinna, G. Held, R. Arrigo
Publisher: Catalysts
DOI: 10.3390/catal10111289 article-journal
Themes: Design (2020)
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Title: Pentablock Copolymer from Tetracomponent Monomer Mixture Using a Switchable Dizinc Catalyst Year: 2018
Authors (3):
T. T. . D. .Chen, Y. Zhu, C. K. Williams
Publisher: Macromolecules
DOI: 10.1021/acs.macromol.8b01224 journal-article
Themes: Transformations (2018)
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Title: Benchmarking quantum mechanical methods for calculating reaction energies of reactions catalyzed by enzymes Year: 2020
Authors (5):
J. Sirirak, N. Lawan, M. W. van der Kamp, J. N. Harvey, A. J. Mulholland
Publisher: PeerJ Physical Chemistry
DOI: 10.7717/peerj-pchem.8 journal-article
Themes: Biocatalysis (2020)
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