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  • Currently displaying 14421 - 14440 of 29292 publications
Author(s)
Publication title
Journal Name
Publication year
Mode-Specific Chemisorption of CH4 on Pt{110}-(1 x 2) Explored by First-Principles Molecular Dynamics
M Sacchi, DJ Wales, SJ Jenkins
The Journal of Physical Chemistry C
(2011)
115
The fourth age of quantum chemistry: Molecules in motion
AG Császár, C Fábri, T Szidarovszky, E Mátyus, T Furtenbacher, G Czakó
Phys Chem Chem Phys
(2011)
14
Irreversible High-Temperature Hydrogen Interaction with the Metal Organic Framework Cu 3 (BTC) 2
A Grzech, J Yang, TJ Dingemans, S Srinivasan, PCMM Magusin, FM Mulder
The Journal of Physical Chemistry C
(2011)
115
“Cofactor”-Controlled Enantioselective Catalysis
P Dydio, C Rubay, T Gadzikwa, M Lutz, JNH Reek
J Am Chem Soc
(2011)
133
Aryl–Aryl Bond Formation by the Fluoride‐Free Cross‐Coupling of Aryldisiloxanes with Aryl Bromides
CM Boehner, EC Frye, KMG O'Connell, WRJD Galloway, HF Sore, PG Dominguez, D Norton, DG Hulcoop, M Owen, G Turner, C Crawford, H Horsley, DR Spring
Chemistry - A European Journal
(2011)
17
Extended surfaces modulate hydrophobic interactions of neighboring solutes
AJ Patel, P Varilly, SN Jamadagni, H Acharya, S Garde, D Chandler
Proceedings of the National Academy of Sciences of USA
(2011)
108
pH-Driven dynamic stereoinduction: epimerization upon dimerization in rhenium(I) complexes.
CM Álvarez, R Carrillo, R García-Rodríguez, D Miguel
Chem Commun (Camb)
(2011)
47
Single crystal nuclear magnetic resonance in spinning powders.
AJ Pell, G Pintacuda, L Emsley
The Journal of chemical physics
(2011)
135
The continuous-flow synthesis of styrenes using ethylene in a palladium-catalysed heck cross-coupling reaction
S Ley, S Bourne, P Koos, M O’Brien, B Martin, B Schenkel, I Baxendale
Synlett
(2011)
2011
Syngas-mediated C-C bond formation in flow: Selective rhodium-catalysed hydroformylation of styrenes
S Ley, S Kasinathan, S Bourne, P Tolstoy, P Koos, M O’Brien, R Bates, I Baxendale
Synlett
(2011)
2011
The solidliquid interface free-energy of Pb: Comparison of theory and experiments
S Angioletti-Uberti
Journal of Physics Condensed Matter
(2011)
23
Energy landscapes of colloidal clusters: thermodynamics and rearrangement mechanisms.
F Calvo, JPK Doye, DJ Wales
Nanoscale
(2011)
4
Some Comments on Topological Approaches to the π-Electron Currents in Conjugated Systems
TK Dickens, JANF Gomes, RB Mallion
J Chem Theory Comput
(2011)
7
Binding of the molecular chaperone αb-crystallin to Aβ amyloid fibrils inhibits fibril elongation
SL Shammas, CA Waudby, S Wang, AK Buell, TPJ Knowles, H Ecroyd, ME Welland, JA Carver, CM Dobson, S Meehan
Biophys J
(2011)
101
The Effect of Linker Histone's Nucleosome Binding Affinity on Chromatin Unfolding Mechanisms
R Collepardo-Guevara, T Schlick
Biophys J
(2011)
101
Thermodynamic Properties of Water Molecules at a Protein Protein Interaction Surface
DJ Huggins, M Marsh, MC Payne
Journal of Chemical Theory and Computation
(2011)
7
Multifunctional nanoprobes for nanoscale chemical imaging and localized chemical delivery at surfaces and interfaces
Y Takahashi, AI Shevchuk, P Novak, Y Zhang, N Ebejer, JV MacPherson, PR Unwin, AJ Pollard, D Roy, CA Clifford, H Shiku, T Matsue, D Klenerman, YE Korchev
Angewandte Chemie International Edition
(2011)
50
Using side-chain aromatic proton chemical shifts for a quantitative analysis of protein structures
AB Sahakyan, WF Vranken, A Cavalli, M Vendruscolo
Angewandte Chemie International Edition
(2011)
50
Imaging and characterisation of the surface of live cells
D Klenerman, YE Korchev, SJ Davis
Current Opinion in Chemical Biology
(2011)
15
Receptor protein tyrosine phosphatases are novel components of a polycystin complex
CA Boucher, HH Ward, RL Case, KS Thurston, X Li, A Needham, E Romero, D Hyink, S Qamar, T Roitbak, S Powell, C Ward, PD Wilson, A Wandinger-Ness, RN Sandford
Biochimica Et Biophysica Acta Molecular Basis of Disease
(2011)
1812