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  • Currently displaying 14881 - 14900 of 29893 publications
Author(s)
Publication title
Journal Name
Publication year
OSCAR4: a flexible architecture for chemical text-mining.
DM Jessop, SE Adams, EL Willighagen, L Hawizy, P Murray-Rust
Journal of Cheminformatics
(2011)
3
The Quixote project: Collaborative and Open Quantum Chemistry data management in the Internet age.
S Adams, P de Castro, P Echenique, J Estrada, MD Hanwell, P Murray-Rust, P Sherwood, J Thomas, J Townsend
Journal of Cheminformatics
(2011)
3
The semantic architecture of the World-Wide Molecular Matrix (WWMM)
P Murray-Rust, SE Adams, J Downing, JA Townsend, Y Zhang
J Cheminform
(2011)
3
The semantics of Chemical Markup Language (CML): dictionaries and conventions
P Murray-Rust, JA Townsend, SE Adams, W Phadungsukanan, J Thomas
Journal of Cheminformatics
(2011)
3
CML: Evolution and design.
P Murray-Rust, HS Rzepa
Journal of Cheminformatics
(2011)
3
Ami - The chemist's amanuensis.
BJ Brooks, AL Thorn, M Smith, P Matthews, S Chen, B O'Steen, SE Adams, JA Townsend, P Murray-Rust
Journal of cheminformatics
(2011)
3
Open Bibliography for Science, Technology, and Medicine
R Jones, M Macgillivray, P Murray-Rust, J Pitman, P Sefton, B O'Steen, W Waites
Journal of Cheminformatics
(2011)
3
Semantic science and its communication - a personal view.
P Murray-Rust
Journal of cheminformatics
(2011)
3
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 Comput Biol
(2011)
7
Stereoselective synthesis of sarmentine
RN Shakhmaev, AU Ishbaeva, AS Sunagatullina, VV Zorin
Russian Journal of General Chemistry
(2011)
81
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
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
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)
(2011)
248
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
Defects in doped LaGaO3 anionic conductors: Linking NMR spectral features, local environments, and defect thermodynamics
F Blanc, DS Middlemiss, Z Gan, CP Grey
J Am Chem Soc
(2011)
133
Mode-Specific Chemisorption of CH4 on Pt{110}-(1 × 2) Explored by First-Principles Molecular Dynamics
M Sacchi, DJ Wales, SJ Jenkins
Journal of Physical Chemistry C
(2011)
115
Irreversible High-Temperature Hydrogen Interaction with the Metal Organic Framework Cu3(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
Journal of the American Chemical Society
(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
(2011)
108