Title: Projector-Based Embedding Eliminates Density Functional Dependence for QM/MM Calculations of Reactions in Enzymes and Solution Year: 2019
Authors (8):
S. J. Bennie, N. Lawan, S. J. Macrae, F. R. Manby, A. J. Mulholland, K. E. Ranaghan, D. Shchepanovska, J. Zurek
Publisher: Journal of Chemical Information and Modeling
DOI: 10.1021/acs.jcim.8b00940 article-journal
Themes: Biocatalysis (2019)
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Title: The influence of porosity on nanoparticle formation in hierarchical aluminophosphates Year: 2019
Authors (6):
J. Callison, P. M. Mhembere, A. E. Oakley, M. E. Potter, R. Raja, L. N. Riley
Publisher: Beilstein Journal of Nanotechnology
DOI: 10.3762/bjnano.10.191 article-journal
Themes: Design (2019), BAG (2019)
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Title: Neutron Scattering - Applications in Biology, Chemistry, and Materials Science Year: 2017
Authors (2):
F. Fernandez-Alonso, D. L. Price
Publisher: Experimental Methods in the Physical Sciences
DOI: 10.1016/b978-0-12-805324-9.09989-1 book
Themes: Featured (2017)
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Title: Catalytic upgrading of bio-oils by esterification Year: 2015
Authors (5):
L. Ciddor, J. A. Bennett, J. A. Hunns, K. Wilson, A. F. Lee
Publisher: Journal of Chemical Technology & Biotechnology
DOI: 10.1002/jctb.4662 journal-article
Themes: Energy (2015)
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Title: Multiscale Workflow for Modeling Ligand Complexes of Zinc Metalloproteins Year: 2021
Authors (8):
Z. Yang, R. M. Twidale, S. Gervasoni, R. Suardíaz, C. K. Colenso, E. J. M. .Lang, J. Spencer, A. J. Mulholland
Publisher: Journal of Chemical Information and Modeling
DOI: 10.1021/acs.jcim.1c01109 journal-article
Themes: Biocatalysis (2021)
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Title: Enzyme evolution and the temperature dependence of enzyme catalysis Year: 2020
Authors (4):
V. L. Arcus, M. W. van der Kamp, C. R. Pudney, A. J. Mulholland
Publisher: Current Opinion in Structural Biology
DOI: 10.1016/j.sbi.2020.06.001 journal-article
Themes: Biocatalysis (2020)
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Title: Study of CO2 permeation in Zn2+‐modified Al2O3‐carbonate membrane Year: 2023
Authors (2):
L. Qu, E. I. Papaioannou
Publisher: Journal of the American Ceramic Society
DOI: 10.1111/jace.19216 journal-article
Themes: Water-Energy (2023)
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Title: Oxide-supported metal catalysts for anaerobic NAD+ regeneration with concurrent hydrogen production Year: 2024
Authors (5):
J. Li, J. W. H. .Burnett, C. M. Macias, R. F. Howe, X. Wang
Publisher: Chinese Chemical Letters
DOI: 10.1016/j.cclet.2023.108737 journal-article
Themes: Water-Energy (2024)
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