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: Nanoporous Carbon: Liquid-Free Synthesis and Geometry-Dependent Catalytic Performance Year: 2019
Authors (16):
D. J. L. .Brett, J. Feng, G. He, Q. He, L. Kang, S. øR. Kegnaes, J. Knossalla, J. Mielby, Y. Qin, F. Schüth, A. -C. Swertz, B. Wang, F. R. Wang, Q. Wang, J. Xie, R. Xu
Publisher: ACS Nano
DOI: 10.1021/acsnano.8b09399 article-journal
Themes: Collaborations (2019), BAG (2019)
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Title: Activation and Deactivation of a Robust Immobilized Cp*Ir-Transfer Hydrogenation Catalyst: A Multielement in Situ X-ray Absorption Spectroscopy Study Year: 2015
Authors (13):
G. J. Sherborne, M. R. Chapman, A. J. Blacker, R. A. Bourne, T. W. Chamberlain, B. D. Crossley, S. J. Lucas, P. C. McGowan, M. A. Newton, T. E. O. Screen, P. B. J. .Thompson, C. E. Willans, B. N. Nguyen
Publisher: Journal of the American Chemical Society
DOI: 10.1021/ja512868a article-journal
Themes: BAG (2015)
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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: Switchable Catalysis Improves the Properties of CO2-Derived Polymers: Poly(cyclohexene carbonate-b-ε-decalactone-b-cyclohexene carbonate) Adhesives, Elastomers, and Toughened Plastics Year: 2020
Authors (9):
G. S. Sulley, G. L. Gregory, T. T. . D. .Chen, L. Pena Carrodeguas, G. Trott, A. Santmarti, K. -Y. Lee, N. J. Terrill, C. K. Williams
Publisher: Journal of the American Chemical Society
DOI: 10.1021/jacs.9b13106 journal-article
Themes: Transformations (2020)
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Title: Co(III)/Alkali-Metal(I) Heterodinuclear Catalysts for the Ring-Opening Copolymerization of CO2 and Propylene Oxide Year: 2020
Authors (4):
A. C. Deacy, E. Moreby, A. Phanopoulos, C. K. Williams
Publisher: Journal of the American Chemical Society
DOI: 10.1021/jacs.0c07980 journal-article
Themes: Circular Economy (2020)
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Title: Sequence Control from Mixtures: Switchable Polymerization Catalysis and Future Materials Applications Year: 2021
Authors (5):
A. C. Deacy, G. L. Gregory, G. S. Sulley, T. T. . D. .Chen, C. K. Williams
Publisher: Journal of the American Chemical Society
DOI: 10.1021/jacs.1c03250 journal-article
Themes: Circular Economy (2021)
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Title: Facile Reversibility by Design: Tuning Small Molecule Capture and Activation by Single Component Frustrated Lewis Pairs Year: 2015
Authors (6):
Z. Mo, E. L. Kolychev, A. Rit, J. Campos, H. Niu, S. Aldridge
Publisher: Journal of the American Chemical Society
DOI: 10.1021/jacs.5b08614 journal-article
Themes: Transformations (2015)
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Title: Catalytic B–N Dehydrogenation Using Frustrated Lewis Pairs: Evidence for a Chain-Growth Coupling Mechanism Year: 2016
Authors (5):
Z. Mo, A. Rit, J. Campos, E. L. Kolychev, S. Aldridge
Publisher: Journal of the American Chemical Society
DOI: 10.1021/jacs.6b01170 journal-article
Themes: Transformations (2016)
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Title: Teaching Enzyme Catalysis Using Interactive Molecular Dynamics in Virtual Reality Year: 2019
Authors (7):
S. J. Bennie, K. E. Ranaghan, H. M. Deeks, H. E. Goldsmith, M. B. O’Connor, A. J. Mulholland, D. R. Glowacki
Publisher: Journal of Chemical Education
DOI: 10.1021/acs.jchemed.9b00181 journal-article
Themes: Biocatalysis (2019)
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