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: Application of “Smart” Amine Donors for Rapid Screening and Scale-Up of Transaminase-Mediated Biotransformations Year: 2018
Authors (8):
A. Gomm, S. Grigoriou, C. Peel, J. Ryan, N. Mujtaba, T. Clarke, E. Kulcinskaja, E. O'Reilly
Publisher: European Journal of Organic Chemistry
DOI: 10.1002/ejoc.201800799 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: Room temperature methoxylation in zeolite H-ZSM-5: an operando DRIFTS/mass spectrometric study Year: 2018
Authors (4):
S. K. Matam, R. F. Howe, A. Thetford, C. R. A. .Catlow
Publisher: Chemical Communications
DOI: 10.1039/c8cc07444e article-journal
Themes: Design (2018)
|
Title: The effects of MTG catalysis on methanol mobility in ZSM-5 Year: 2018
Authors (11):
S. K. Matam, A. J. O'Malley, C. R. A. .Catlow, Suwardiyanto, P. Collier, A. P. Hawkins, A. Zachariou, D. Lennon, I. P. Silverwood, S. F. Parker, R. F. Howe
Publisher: Catalysis Science & Technology
DOI: 10.1039/c8cy00422f article-journal
Themes: Design (2018)
|
Title: Comparing ammonia diffusion in NH3-SCR zeolite catalysts: a quasielastic neutron scattering and molecular dynamics simulation study Year: 2018
Authors (7):
A. J. O'Malley, M. Sarwar, J. Armstrong, C. R. A. .Catlow, I. P. Silverwood, A. P. E. .York, I. Hitchcock
Publisher: Physical Chemistry Chemical Physics
DOI: 10.1039/c8cp01022f article-journal
Themes: Design (2018)
|
Title: Determination of Molybdenum Species Evolution during Non‐Oxidative Dehydroaromatization of Methane and its Implications for Catalytic Performance Year: 2018
Authors (7):
M. Agote-Arán, A. B. Kroner, H. U. Islam, W. A. Sławiński, D. S. Wragg, I. Lezcano-González, A. M. Beale
Publisher: ChemCatChem
DOI: 10.1002/cctc.201801299 article-journal
Themes: Design (2018)
|
Title: Mean Intrinsic Activity of Single Mn Sites at LaMnO3 Nanoparticles Towards the Oxygen Reduction Reaction Year: 2018
Authors (7):
V. Celorrio, L. Calvillo, C. A. M. .van den Bosch, G. Granozzi, A. Aguadero, A. E. Russell, D. J. Fermín
Publisher: ChemElectroChem
DOI: 10.1002/celc.201800729 article-journal
Themes: Design (2018), BAG (2018)
|
Title: Insights into the durability of Co–Fe spinel oxygen evolution electrocatalystsvia operandostudies of the catalyst structure Year: 2018
Authors (11):
L. Calvillo, F. Carraro, O. Vozniuk, V. Celorrio, L. Nodari, A. E. Russell, D. Debellis, D. J. Fermín, F. Cavani, S. Agnoli, G. Granozzi
Publisher: Journal of Materials Chemistry A
DOI: 10.1039/c7ta10892c article-journal
Themes: Design (2018)
|
Title: Effect of Ba Content on the Activity of La1-xBaxMnO3 Towards the Oxygen Reduction Reaction Year: 2018
Authors (6):
G. P. . A. .Gobaille-Shaw, V. Celorrio, L. Calvillo, L. J. Morris, G. Granozzi, D. J. Fermín
Publisher: ChemElectroChem
DOI: 10.1002/celc.201800052 article-journal
Themes: Design (2018)
|