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  • Currently displaying 21161 - 21180 of 30861 publications
Author(s)
Publication title
Journal Name
Publication year
A global resource for computational chemistry
P Murray-Rust, HS Rzepa, JJP Stewart, Y Zhang
J Mol Model
(2005)
11
Impact of natural variation in bacterial F17G adhesins on crystallization behaviour
L Buts, A Wellens, I Van Molle, L Wyns, R Loris, M Lahmann, S Oscarson, H De Greve, J Bouckaert
Acta Crystallogr D Biol Crystallogr
(2005)
61
Influence of copper on the electronic properties of amorphous chalcogenides - art. no. 020202
SI Simdyankin, M Elstner, TA Niehaus, T Frauenheim, SR Elliott
Physical Review B Condensed Matter and Materials Physics
(2005)
72
Structure and equation of state of interaction site models for disc-shaped lamellar colloids
DC *, J-P Hansen, L HarNau
Molecular Physics
(2005)
103
Global minima of (C60)nCa2+, (C60)nF- and (C60)nI- clusters
J Hernández-Rojas, J Bretón, JMG Llorente, DJ Wales
Chem. Phys. Lett.
(2005)
410
Model car-exhaust catalyst studied by TPD and TP-RAIRS: Surface reactions of NO on clean and O-covered Ir{1 0 0}
S Khatua, G Held, DA King
Surface Science
(2005)
586
Water and the Huisgen Cycloaddition Reaction: A Focus on Polar Contributions to the Transition State in the Reactions of Dicyano(phthalazinium)methanide with Substituted Styrenes and Benzylidene Acetones
RN Butler, AG Coyne, WJ Cunningham, EM Moloney, LA Burke
Helvetica Chimica Acta
(2005)
88
Effects of nanoconfinement on the morphology and reactivity of organic materials
WTS Huck
Chemical Communications
(2005)
Adsorption of Gelatin to a Polystyrene/Water Interface as a Function of Concentration, pH, and Ionic Strength †
SF Turner, SM Clarke, AR Rennie, PN Thirtle, ZX Li, RK Thomas, S Langridge, J Penfold
Langmuir
(2005)
21
Long time tails in stress correlation functions
MHJ Hagen, CP Lowe, D Frenkel
25 YEARS OF NON-EQUILIBRIUM STATISTICAL MECHANICS
(2005)
445
Communication and re-use of chemical information in bioscience - art. no. 180
P Murray-Rust, JBO Mitchell, HS Rzepa
BMC Bioinformatics
(2005)
6
Extinction of epidemics in lattice models with quenched disorder.
SN Taraskin, JJ Ludlam, CJ Neugebauer, CA Gilligan
Phys Rev E Stat Nonlin Soft Matter Phys
(2005)
72
A network of orthogonal ribosome·mrna pairs
O Rackham, JW Chin
Nature chemical biology
(2005)
1
N,N′-bis(pyridin-4-ylmethyl)succinamide-terephthalic acid (1/1)
CL Oliver, GO Lloyd, EJC Vries
Acta Crystallographica Section E Structure Reports Online
(2005)
61
Statistical properties of the critical eigenstates in power-law random banded matrices across the band
CJ Paley, SN Taraskin, SR Elliott
Physical Review B
(2005)
72
Quantum Scattering Studies of Reactions
SC Althorpe
(2005)
Universal features of localized eigenstates in disordered systems
JJ Ludlam, SN Taraskin, SR Elliott, DA Drabold
Journal of Physics Condensed Matter
(2005)
17
Energy-dependent cancellation of diffraction spots due to surface roughening.
SR Puisto, G Held, DA King
Phys Rev Lett
(2005)
95
Why copper is intrinsically more selective than silver in alkene epoxidation: ethylene oxidation on Cu(111) versus Ag(111).
D Torres, N Lopez, F Illas, RM Lambert
J Am Chem Soc
(2005)
127
Interactions of triiodide cluster ion with solvents
FS Zhang, RM Lynden-Bell
The European Physical Journal D
(2005)
34