Title: Quantum Mechanics/Molecular Mechanics Simulations Show Saccharide Distortion is Required for Reaction in Hen Egg‐White Lysozyme Year: 2018
Authors (4):
M. A. L. .Limb, R. Suardíaz, I. M. Grant, A. J. Mulholland
Publisher: Chemistry - A European Journal
DOI: 10.1002/chem.201805250 article-journal
Themes: Biocatalysis (2018)
|
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)
|
Title: A Noncanonical Proximal Heme Ligand Affords an Efficient Peroxidase in a Globin Fold Year: 2018
Authors (6):
M. Pott, T. Hayashi, T. Mori, P. R. E. .Mittl, A. P. Green, D. Hilvert
Publisher: Journal of the American Chemical Society
DOI: 10.1021/jacs.7b12621 article-journal
Themes: Biocatalysis (2018)
|
Title: Operando spectroscopy study of the carbon dioxide electro-reduction by iron species on nitrogen-doped carbon Year: 2018
Authors (17):
C. Genovese, M. E. Schuster, E. K. Gibson, D. Gianolio, V. Posligua, R. Grau-Crespo, G. Cibin, P. P. Wells, D. Garai, V. Solokha, S. Krick Calderon, J. J. Velasco-Vélez, C. Ampelli, S. Perathoner, G. Held, G. Centi, R. Arrigo
Publisher: Nature Communications
DOI: 10.1038/s41467-018-03138-7 article-journal
Themes: Design (2018), BAG (2018)
|
Title: Indium Catalysts for Low-Pressure CO2/Epoxide Ring-Opening Copolymerization: Evidence for a Mononuclear Mechanism? Year: 2018
Authors (6):
A. Thevenon, A. Cyriac, D. Myers, A. J. P. .White, C. B. Durr, C. K. Williams
Publisher: Journal of the American Chemical Society
DOI: 10.1021/jacs.8b01920 article-journal
Themes: Transformations (2018)
|
Title: The Role of Mg(OH)2 in the So-Called “Base-Free” Oxidation of Glycerol with AuPd Catalysts Year: 2018
Authors (8):
J. Fu, Q. He, P. J. Miedziak, G. L. Brett, X. Huang, S. Pattisson, M. Douthwaite, G. J. Hutchings
Publisher: Chemistry - A European Journal
DOI: 10.1002/chem.201704151 article-journal
Themes: Environment (2018)
|
Title: Optimizing spatial pore-size and porosity distributions of adsorbents for enhanced adsorption and desorption performance Year: 2015
Authors (6):
G. Ye, X. Duan, K. Zhu, X. Zhou, M. -O. Coppens, W. Yuan
Publisher: Chemical Engineering Science
DOI: 10.1016/j.ces.2015.04.024 article-journal
Themes: Design (2015)
|
Title: Mechanism of the Catalytic Carboxylation of Alkylboronates with CO2 Using Ni−NHC Complexes: A DFT Study Year: 2017
Authors (5):
M. Delarmelina, E. Marelli, J. W. de M. Carneiro, S. P. Nolan, M. Bühl
Publisher: Chemistry - A European Journal
DOI: 10.1002/chem.201703567 article-journal
Themes: Energy (2017), Environment (2017)
|
Title: Heterogeneously Catalyzed Hydrothermal Processing of C5–C6 Sugars Year: 2016
Authors (3):
X. Zhang, K. Wilson, A. F. Lee
Publisher: Chemical Reviews
DOI: 10.1021/acs.chemrev.6b00311 article-journal
Themes: Energy (2016), Transformations (2016)
|
Title: Neutron Scattering of Aromatic and Aliphatic Liquids Year: 2016
Authors (5):
M. Falkowska, D. T. Bowron, H. G. Manyar, C. Hardacre, T. G. A. .Youngs
Publisher: ChemPhysChem
DOI: 10.1002/cphc.201600149 article-journal
Themes: Energy (2016)
|