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  • Currently displaying 14361 - 14380 of 29246 publications
Author(s)
Publication title
Journal Name
Publication year
Phase Diagram of Hard Ellipsoids of Revolution
D Frenkel, BM Mulder, JP Mctague
Molecular Crystals and Liquid Crystals
(2011)
123
Preface
SJ Jenkins
Topics in Catalysis
(2011)
54
Multicolored and white-light phosphors based on doped GdF3 nanoparticles and their potential bio-applications
FN Sayed, V Grover, V Sudarsan, BN Pandey, A Asthana, RK Vatsa, AK Tyagi
Journal of colloid and interface science
(2011)
367
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
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
J Cheminform
(2011)
3
Semantic science and its communication - a personal view.
P Murray-Rust
J Cheminform
(2011)
3
The semantic architecture of the World-Wide Molecular Matrix (WWMM)
P Murray-Rust, SE Adams, J Downing, JA Townsend, Y Zhang
Journal of Cheminformatics
(2011)
3
CMLLite: a design philosophy for CML
JA Townsend, 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
Mining chemical information from open patents.
DM Jessop, SE Adams, P Murray-Rust
Journal of Cheminformatics
(2011)
3
OSCAR4: a flexible architecture for chemical text-mining.
DM Jessop, SE Adams, EL Willighagen, L Hawizy, P Murray-Rust
Journal of Cheminformatics
(2011)
3
H2 molecules encapsulated in extended Ben cluster cages: toward light-metal nanofoams for hydrogen storage.
FY Naumkin, DJ Wales
The Journal of Physical Chemistry A
(2011)
115
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
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 : PCCP
(2011)
14
Mode-Specific Chemisorption of CH4 on Pt{110}-(1 x 2) Explored by First-Principles Molecular Dynamics
M Sacchi, DJ Wales, SJ Jenkins
Journal of Physical Chemistry C
(2011)
115
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
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
Angewandte Chemie International Edition
(2011)
50