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  • Currently displaying 19461 - 19480 of 30157 publications
Author(s)
Publication title
Journal Name
Publication year
Space-time thermodynamics and subsystem observables in a kinetically constrained model of glassy materials.
RL Jack, JP Garrahan, D Chandler
The Journal of Chemical Physics
(2006)
125
Order-disorder transition in monoclinic sulfur: A precise structural study by high-resolution neutron powder diffraction
WIF David, RM Ibberson, SFJ Cox, PT Wood
Acta Crystallographica Section B: Structural Science, Crystal Engineering and Materials
(2006)
62
Order-disorder transition in monoclinic sulfur: a precise structural study by high-resolution neutron powder diffraction.
WIF David, RM Ibberson, SFJ Cox, PT Wood
Acta crystallographica. Section B, Structural science
(2006)
62
The tubulin-bound conformation of discodermolide derived by NMR studies in solution supports a common pharmacophore model for epothilone and discodermolide.
VM Sánchez-Pedregal, K Kubicek, J Meiler, I Lyothier, I Paterson, T Carlomagno
Angewandte Chemie International Edition
(2006)
45
Pyridyl ‘ring-flipping’ in the dimers [Me2E(2-py)]2(E = B, Al, Ga; 2-py = 2-pyridyl)
F García, AD Hopkins, RA Kowenicki, M McPartlin, JS Silvia, JM Rawson, MC Rogers, DS Wright
Chemical Communications
(2006)
Energy transfer in thermal and hyperthermal collisions between CN(X-2 Sigma(+), v=2) in selected rotational levels (N-i = 0, 1, 6, 10, 15 and 20) and N-2
RV Olkhov, IWM Smith
Physical chemistry chemical physics : PCCP
(2006)
8
Cis- and trans-bis(2-cyanoethylsulfanyl)(decane-1,10-diyldithio)tetrathiafulvalene
S Nygaard, AH Flood, JO Jeppesen, AD Bond
Acta crystallographica. Section C, Crystal structure communications
(2006)
62
A Comparison of the Folding of Two Knotted Proteins: YbeA and YibK
AL Mallam, SE Jackson
J Mol Biol
(2006)
366
Transmembrane Helix−Helix Interactions:  Comparative Simulations of the Glycophorin A Dimer
JM Cuthbertson, PJ Bond, MSP Sansom
Biochemistry
(2006)
45
Exploring cocrystal-cocrystal reactivity via liquid-assisted grinding: the assembling of racemic and dismantling of enantiomeric cocrystals.
T Friscić, L Fábián, JC Burley, W Jones, WDS Motherwell
Chem. Commun.
(2006)
Real-time observation of nonadiabatic surface dynamics: The first picosecond in the dissociation of NO on iridium
IM Lane, DA King, ZP Liu, H Arnolds
Physical Review Letters
(2006)
97
Simulating self-assembly of ZnS nanoparticles into mesoporous materials.
DC Sayle, BC Mangili, J Klinowski, TXT Sayle
Journal of the American Chemical Society
(2006)
128
Metal Chelate Formation Using a Task-Specific Ionic Liquid
JR Harjani, T Friscić, LR MacGillivray, RD Singer
Inorganic Chemistry
(2006)
45
The surface structure of ionic liquids: comparing simulations with x-ray measurements.
E Sloutskin, RM Lynden-Bell, S Balasubramanian, M Deutsch
The Journal of chemical physics
(2006)
125
A novel, sensitive potentiometric hydrocarbon sensor for high-vacuum applications.
G Kyriakou, DJ Davis, RB Grant, MS Tikhov, A Keen, P Pakianathan, RM Lambert
Journal of Physical Chemistry B
(2006)
110
Geometry, Energetics, and Dynamics of Hydrogen Bonds in Proteins:  Structural Information Derived from NMR Scalar Couplings
J Gsponer, H Hopearuoho, A Cavalli, CM Dobson, M Vendruscolo
J Am Chem Soc
(2006)
128
Chapter 9 Molecular Similarity: Advances in Methods, Applications and Validations in Virtual Screening and QSAR.
A Bender, JL Jenkins, Q Li, SE Adams, EO Cannon, RC Glen
Annual reports in computational chemistry
(2006)
2
Amphiphilic Model Conetworks Based on Cross-Linked Star Copolymers of Benzyl Methacrylate and 2-(Dimethylamino)ethyl Methacrylate: Synthesis, Characterization, and DNA Adsorption Studies
DS Achilleos, TK Georgiou, CS Patrickios
Biomacromolecules
(2006)
7
Mechanically Induced Generation of Counterions Inside Surface‐Grafted Charged Macromolecular Films: Towards Enhanced Mechanotransduction in Artificial Systems
O Azzaroni, B Trappmann, P van Rijn, F Zhou, B Kong, WTS Huck
Angewandte Chemie International Edition
(2006)
45
Cocrystallisation of succinic and fumaric acids with lutidines: a systematic study
DA Haynes, W Jones, WDS Motherwell
CrystEngComm
(2006)
8