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  • Currently displaying 19381 - 19400 of 29295 publications
Author(s)
Publication title
Journal Name
Publication year
Anatomy of a grid-enabled molecular simulation study: the compressibility of amorphous silica
AM Walker, MT Dove, LA Sullivan, K Trachenko, RP Bruin, TO White, P Murray-RuSt, RP Tyer, PA Couch, IT Todorov, W Smith, KK van Dam
PROCEEDINGS OF THE UK E-SCIENCE ALL HANDS MEETING 2006
(2006)
Polymer-Supported Reagents and Scavengers in Synthesis in Comprehensive Medicinal Chemistry II
RM Myers, SV Ley, IR Baxendale
(2006)
3
The Use of Polymer Supported Reagents and Scavengers in the Synthesis of Natural Products in Combinatorial Synthesis of Natural Product-Based Libraries
RM Myers, IR Baxendale, SV Ley
(2006)
Ch. 6
Theory of C 2H x Species on Pt110(1 x 2): Structure, Stability, and Thermal Chemistry.
AT Anghel, SJ Jenkins, DJ Wales, DA King
J. Phys. Chem. B
(2006)
110
Kinetic analysis of discrete path sampling stationary point databases.
SA Trygubenko, DJ Wales
Mol. Phys.
(2006)
104
Global Potential Energy Minima of C 6 0(H 2O) n Clusters.
J Hernández-Rojas, J Breton, JMG Llorente, DJ Wales
J. Phys. Chem. B
(2006)
110
Potential Energy and Free Energy Landscapes.
DJ Wales, TV Bogdan
J. Phys. Chem. B
(2006)
110
Correlation effects and super-Arrhenius diffusion in binary Lennard- Jones mixtures (12 pages).
VK de Souza, DJ Wales
Phys. Rev. Lett.
(2006)
96
Thermodynamics of water octamer in a uniform electric field (5 pages).
J Hernández-Rojas, BS Gonzalez, T James, DJ Wales
J. Chem. Phys.
(2006)
125
Diastereoselective aldol reactions with butane-2,3-diacetal protected glyceraldehyde derivatives (vol 4, pg 1471, 2006)
KR Knudsen, AF Stepan, P Michel, SV Ley
ORGANIC & BIOMOLECULAR CHEMISTRY
(2006)
4
Multi-model ensemble simulations of tropospheric NO 2 compared with GOME retrievals for the year 2000
TPC Van Noije, HJ Eskes, FJ Dentener, DS Stevenson, K Ellingsen, MG Schultz, O Wild, M Amann, CS Atherton, DJ Bergmann, I Bey, KF Boersma, T Butler, J Cofala, J Drevet, AM Fiore, M Gauss, DA Hauglustaine, LW Horowitz, ISA Isaksen, MC Krol, J-F Lamarque, MG Lawrence, RV Martin, V Montanaro, J-F Müller, G Pitari, MJ Prather, JA Pyle, A Richter, JM Rodriguez, NH Savage, SE Strahan, K Sudo, S Szopa, M Van Roozendael
Atmospheric Chemistry and Physics Discussions
(2006)
6
Functionalised fibrils for bio-nanotechnology
SL Gras, AM Squires, CM Dobson, CE MacPhee
2006 INTERNATIONAL CONFERENCE ON NANOSCIENCE AND NANOTECHNOLOGY, VOLS 1 AND 2
(2006)
Developing lightweight application execution mechanisms in grids
L He, M Dove, M Hayes, P Murray-Rust, M Calleja, X Yang, V Mman
Proceedings of the UK e-Science All Hands Meeting 2006
(2006)
Synthesis of monolithic silica materials with meso macro-porous double-pore structure
H Yang, J Li, Q Chen, L Song, J Lu
Kuei Suan Jen Hsueh Pao Journal of the Chinese Ceramic Society
(2006)
34
Lecture Notes in Computer Science (including subseries Lecture Notes in Artificial Intelligence and Lecture Notes in Bioinformatics): Preface
MR Berthold, R Glen
Lecture Notes in Computer Science Including Subseries Lecture Notes in Artificial Intelligence and Lecture Notes in Bioinformatics
(2006)
4216 LNBI
An Architecture for Language Processing for Scientific Texts
C Ann, C Peter, M Peter, R CJ, S Advaith, T Simone, W Ben
PROCEEDINGS OF THE UK E-SCIENCE ALL HANDS MEETING 2006
(2006)
Single scan TROSY and E.COSY suite of experiments for the measurement of residual dipolar couplings in proteins
T Eliseo, M Gallo, R Melis, M Paci, R Bazzo, DO Cicero
Journal of Spectroscopy
(2006)
20
Theory of simple liquids
JP Hansen, IR McDonald
(2006)
Application and uses of CML within the eMinerals project
TOH White, P Murray-Rust, PA Couch, RP Tyer, RP Bruin, IT Todorov, DJ Wilson, MT Dove, KF Austen, SC Parker
Proceedings of the UK e-Science All Hands Meeting 2006
(2006)
Light propagation in tunable photonic materials
DS Wiersma, J Bertolotti, S Gottardo, F Intonti, S Mujumdar, R Sapienza, C Toninelli, S Vignolini
Optics Infobase Conference Papers
(2006)
53