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Yusuf Hamied Department of Chemistry

 

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  • Currently displaying 14181 - 14200 of 29383 publications
OSCAR4: a flexible architecture for chemical text-mining
DM Jessop, SE Adams, EL Willighagen, L Hawizy, P Murray-Rust
– Journal of cheminformatics
(2011)
3,
41
(doi: 10.1186/1758-2946-3-41)
CMLLite: a design philosophy for CML.
JA Townsend, P Murray-Rust
– Journal of cheminformatics
(2011)
3,
39
(doi: 10.1186/1758-2946-3-39)
Open Data, Open Source and Open Standards in chemistry: The Blue Obelisk five years on
NM O'Boyle, R Guha, EL Willighagen, SE Adams, J Alvarsson, J-C Bradley, IV Filippov, RM Hanson, MD Hanwell, GR Hutchison, CA James, N Jeliazkova, AS Lang, KM Langner, DC Lonie, DM Lowe, J Pansanel, D Pavlov, O Spjuth, C Steinbeck, AL Tenderholt, KJ Theisen, P Murray-Rust
– J Cheminform
(2011)
3,
37
(doi: 10.1186/1758-2946-3-37)
Mode-Specific Chemisorption of CH4 on Pt{110}-(1 × 2) Explored by First-Principles Molecular Dynamics
M Sacchi, DJ Wales, SJ Jenkins
– The Journal of Physical Chemistry C
(2011)
115,
21832
(doi: 10.1021/jp207746q)
Stereoselective synthesis of sarmentine
RN Shakhmaev, AU Ishbaeva, AS Sunagatullina, VV Zorin
– Russian Journal of General Chemistry
(2011)
81,
1915
(doi: 10.1134/s1070363211090337)
The fourth age of quantum chemistry: molecules in motion.
AG Császár, C Fábri, T Szidarovszky, E Mátyus, T Furtenbacher, G Czakó
– Physical Chemistry Chemical Physics
(2011)
14,
1085
(doi: 10.1039/c1cp21830a)
Inversion of the Balance between Hydrophobic and Hydrogen Bonding Interactions in Protein Folding and Aggregation
AW Fitzpatrick, TPJ Knowles, CA Waudby, M Vendruscolo, CM Dobson
– PLoS computational biology
(2011)
7,
e1002169
(doi: 10.1371/journal.pcbi.1002169)
Defects in Doped LaGaO3 Anionic Conductors: Linking NMR Spectral Features, Local Environments, and Defect Thermodynamics
F Blanc, DS Middlemiss, Z Gan, CP Grey
– Journal of the American Chemical Society
(2011)
133,
17662
(doi: 10.1021/ja2053557)
Amphiphile replacement on carbon nanotube surfaces: Effect of aromatic groups on the interaction strength
P Bluemmel, A Setaro, CS Popeney, B Trappmann, R Haag, S Reich
– Physica Status Solidi B Basic Research
(2011)
248,
2532
(doi: 10.1002/pssb.201100515)
Fast Resonance Assignment and Fold Determination of Human Superoxide Dismutase by High‐Resolution Proton‐Detected Solid‐State MAS NMR Spectroscopy
MJ Knight, AL Webber, AJ Pell, P Guerry, E Barbet-Massin, I Bertini, IC Felli, L Gonnelli, R Pierattelli, L Emsley, A Lesage, T Herrmann, G Pintacuda
– Angew Chem Int Ed Engl
(2011)
50,
11697
(doi: 10.1002/anie.201106340)
Structure of a Blinkin-BUBR1 Complex Reveals an Interaction Crucial for Kinetochore-Mitotic Checkpoint Regulation via an Unanticipated Binding Site
VM Bolanos-Garcia, T Lischetti, D Matak-Vinković, E Cota, PJ Simpson, DY Chirgadze, DR Spring, CV Robinson, J Nilsson, TL Blundell
– Structure (London, England : 1993)
(2011)
19,
1691
(doi: 10.1016/j.str.2011.09.017)
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,
21521
(doi: 10.1021/jp206821f)
“Cofactor”-Controlled Enantioselective Catalysis
P Dydio, C Rubay, T Gadzikwa, M Lutz, JNH Reek
– Journal of the American Chemical Society
(2011)
133,
17176
(doi: 10.1021/ja208589c)
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,
13230
(doi: 10.1002/chem.201102285)
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,
17678
(doi: 10.1073/pnas.1110703108)
Single crystal nuclear magnetic resonance in spinning powders.
AJ Pell, G Pintacuda, L Emsley
– The Journal of Chemical Physics
(2011)
135,
144201
(doi: 10.1063/1.3640418)
Determination of conformational equilibria in proteins using residual dipolar couplings
A De Simone, RW Montalvao, M Vendruscolo
– J Chem Theory Comput
(2011)
7,
4189
(doi: 10.1021/ct200361b)
pH-driven dynamic stereoinduction: epimerization upon dimerization in rhenium(i) complexes
CM Álvarez, R Carrillo, R García-Rodríguez, D Miguel
– Chemical Communications
(2011)
47,
12765
(doi: 10.1039/c1cc14799d)
The Continuous-Flow Synthesis of Styrenes Using Ethylene in a Palladium-Catalysed Heck Cross-Coupling Reaction
SL Bourne, P Koos, M O'Brien, B Martin, B Schenkel, IR Baxendale, SV Ley
– Synlett
(2011)
2011,
2643
(doi: 10.1055/s-0031-1289291)
Syngas-mediated C-C bond formation in flow: Selective rhodium-catalysed hydroformylation of styrenes
S Kasinathan, SL Bourne, P Tolstoy, P Koos, M O'Brien, RW Bates, IR Baxendale, SV Ley
– Synlett
(2011)
2011,
2648
(doi: 10.1055/s-0031-1289292)

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