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: 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: Macrocyclic Dizinc(II) Alkyl and Alkoxide Complexes: Reversible CO2 Uptake and Polymerization Catalysis Testing Year: 2015
Authors (5):
C. Romain, M. S. Bennington, A. J. P. .White, C. K. Williams, S. Brooker
Publisher: Inorganic Chemistry
DOI: 10.1021/acs.inorgchem.5b02038 article-journal
Themes: Transformations (2015)
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Title: Dinuclear Zinc Salen Catalysts for the Ring Opening Copolymerization of Epoxides and Carbon Dioxide or Anhydrides Year: 2015
Authors (4):
A. Thevenon, J. A. Garden, A. J. P. .White, C. K. Williams
Publisher: Inorganic Chemistry
DOI: 10.1021/acs.inorgchem.5b02233 article-journal
Themes: Transformations (2015)
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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: Instantaneous and Phosphine-Catalyzed Arene Binding and Reduction by U(III) Complexes Year: 2021
Authors (4):
P. L. Arnold, C. J. V. .Halliday, L. Puig-Urrea, G. S. Nichol
Publisher: Inorganic Chemistry
DOI: 10.1021/acs.inorgchem.1c00327 article-journal
Themes: Transformations (2021)
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Title: Groups 1, 2 and Zn(II) Heterodinuclear Catalysts for Epoxide/CO2 Ring-Opening Copolymerization Year: 2018
Authors (5):
A. C. Deacy, C. B. Durr, J. A. Garden, A. J. P. .White, C. K. Williams
Publisher: Inorganic Chemistry
DOI: 10.1021/acs.inorgchem.8b02923 journal-article
Themes: Transformations (2018)
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Title: Improving Photocatalytic Energy Conversion via NAD(P)H Year: 2020
Authors (5):
W. Jones, J. W. H. .Burnett, J. Shi, R. F. Howe, X. Wang
Publisher: Joule
DOI: 10.1016/j.joule.2020.07.024 journal-article
Themes: Water-Energy (2020)
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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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Title: Direct air capture: process technology, techno-economic and socio-political challenges Year: 2022
Authors (6):
M. Erans, E. S. Sanz-Pérez, D. P. Hanak, Z. Clulow, D. M. Reiner, G. A. Mutch
Publisher: Energy & Environmental Science
DOI: 10.1039/d1ee03523a journal-article
Themes: Circular Economy (2022)
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