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: 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: Combined In Situ XAFS/DRIFTS Studies of the Evolution of Nanoparticle Structures from Molecular Precursors Year: 2017
Authors (11):
E. K. Dann, E. K. Gibson, C. R. A. .Catlow, P. Collier, T. Eralp Erden, D. Gianolio, C. Hardacre, A. B. Kroner, A. Raj, A. Goguet, P. P. Wells
Publisher: Chemistry of Materials
DOI: 10.1021/acs.chemmater.7b02552 article-journal
Themes: Design (2017), BAG (2017)
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Title: Restructuring of AuPd Nanoparticles Studied by a Combined XAFS/DRIFTS Approach Year: 2015
Authors (11):
E. K. Gibson, A. M. Beale, C. R. A. .Catlow, A. Chutia, D. Gianolio, A. L. Gould, A. B. Kroner, K. M. H. .Mohammed, M. Perdjon, S. M. Rogers, P. P. Wells
Publisher: Chemistry of Materials
DOI: 10.1021/acs.chemmater.5b00866 article-journal
Themes: Design (2015), BAG (2015)
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Title: Highly Tunable Catalyst Supports for Single-Site Ethylene Polymerization Year: 2015
Authors (8):
J. -C. Buffet, N. Wanna, T. A. Q. .Arnold, E. K. Gibson, P. P. Wells, Q. Wang, J. Tantirungrotechai, D. O’Hare
Publisher: Chemistry of Materials
DOI: 10.1021/cm503433q article-journal
Themes: Design (2015), BAG (2015)
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Title: Tellurium-doped lanthanum manganite as catalysts for the oxygen reduction reaction Year: 2017
Authors (5):
V. Celorrio, L. J. Morris, M. Cattelan, N. A. .Fox, D. J. Fermín
Publisher: MRS Communications
DOI: 10.1557/mrc.2017.22 article-journal
Themes: Energy (2017)
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Title: Photomodulable phosphines incorporating diarylethene moieties Year: 2015
Authors (4):
G. Bianchini, G. Strukul, D. F. Wass, A. Scarso
Publisher: RSC Advances
DOI: 10.1039/c4ra16127k article-journal
Themes: Transformations (2015)
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Title: Extracting structural information of Au colloids at ultra-dilute concentrations: identification of growth during nanoparticle immobilization Year: 2019
Authors (11):
N. Abdullah, M. Briceno de Gutierrez, C. R. A. .Catlow, P. Collier, D. Decarolis, N. Dimitratos, S. Hayama, S. M. Rogers, G. F. Tierney, A. Villa, P. P. Wells
Publisher: Nanoscale Advances
DOI: 10.1039/c9na00159j article-journal
Themes: Design (2019)
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Title: Low-temperature studies of propene oligomerization in ZSM-5 by inelastic neutron scattering spectroscopy Year: 2019
Authors (7):
P. Collier, R. A. Ewings, A. P. Hawkins, R. F. Howe, D. Lennon, S. F. Parker, A. Zachariou
Publisher: RSC Advances
DOI: 10.1039/c9ra03568k article-journal
Themes: Design (2019)
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Title: Self-Limiting Growth of Two-Dimensional Palladium between Graphene Oxide Layers Year: 2019
Authors (12):
S. J. Haigh, C. Hardacre, C. Hu, K. Huang, V. G. Kravets, R. R. Nair, M. Neek-Amal, F. M. Peeters, E. Prestat, V. K. Puthiyapura, Y. Su, H. Xiao
Publisher: Nano Letters
DOI: 10.1021/acs.nanolett.9b01733 article-journal
Themes: Energy (2019)
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