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  • Currently displaying 18681 - 18700 of 29295 publications
Author(s)
Publication title
Journal Name
Publication year
Solvation in modified water models: towards understanding hydrophobic effects
RM Lynden-bell, T Head-gordon
Molecular Physics
(2006)
104
Charge-transfer molecular dynamics
A Alavi, LJ Alvarez, SR Elliott, IR McDonald
Philosophical Magazine B
(2006)
65
Testing the relevance of effective interaction potentials between highly-charged colloids in suspension
J Dobnikar, R Castañeda-Priego, HH von Grünberg, E Trizac
NEW J PHYS
(2006)
8
Athermal models for diblock copolymer self-assembly
J-P Hansen, C Pearson
Molecular Physics
(2006)
104
Membrane simulations of OpcA: Gating in the loops?
PJ Bond, JP Derrick, MSP Sansom
Biophysical journal
(2006)
92
Application of the optimized Baxter model to the hard-core attractive Yukawa system
P Prinsen, JC Pàmies, T Odijk, D Frenkel
Journal of Chemical Physics
(2006)
125
Sulfur dioxide fluxes from the volcanoes of Hokkaido, Japan
T Mori, K Kazahaya, C Oppenheimer, AJS McGonigle, V Tsanev, R Olmos, M Ohwada, T Shuto
Journal of Volcanology and Geothermal Research
(2006)
158
A Simple Nanomixer for Single‐Molecule Kinetics Measurements
SS White, S Balasubramanian, D Klenerman, L Ying
Angewandte Chemie
(2006)
118
Screening for Inclusion Compounds and Systematic Construction of Three‐Component Solids by Liquid‐Assisted Grinding
T Friscić, AV Trask, W Jones, WDS Motherwell
Angewandte Chemie International Edition
(2006)
45
A Simple Nanomixer for Single‐Molecule Kinetics Measurements
SS White, S Balasubramanian, D Klenerman, L Ying
Angew Chem Int Ed Engl
(2006)
45
Tilt the molecule and change the chemistry: mechanism of S-promoted chemoselective catalytic hydrogenation of crotonaldehyde on Cu(111).
ME Chiu, DJ Watson, G Kyriakou, MS Tikhov, RM Lambert
Angewandte Chemie International Edition
(2006)
45
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 Crystallogr B
(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(X2Sigma+, v = 2) in selected rotational levels (Ni = 0, 1, 6, 10, 15 and 20) and N2.
RV Olkhov, IWM Smith
Physical Chemistry Chemical Physics
(2006)
8
Cis- andtrans-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
Journal of Molecular Biology
(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
Chemical communications (Cambridge, England)
(2006)