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  • Currently displaying 16881 - 16900 of 29917 publications
Author(s)
Publication title
Journal Name
Publication year
DL-FIND: An Open-Source Geometry Optimizer for Atomistic Simulations
J Kästner, JM Carr, TW Keal, W Thiel, A Wander, P Sherwood
J Phys Chem A
(2009)
113
Phase diagram of Hertzian spheres.
JC Pàmies, A Cacciuto, D Frenkel
The Journal of chemical physics
(2009)
131
Investigation of the conversion reaction mechanisms for binarycopper(ii) compounds by solid-state nmr spectroscopy and X-ray diffraction
N Yamakawa, M Jiang, CP Grey
Chemistry of Materials
(2009)
21
Copper(II), iron(III) and cobalt(III) complexes of the pendent-arm cyclam derivative 6,6,13-trimethyl-13-amino-1,4,8,11-tetraazacyclotetradecane
JK Clegg, LF Lindoy, P Thuéry, YH Lee, DKA Kusumohastuti, C Mora, HH Kim, JH Cho, Y Kim
Journal of Inclusion Phenomena and Macrocyclic Chemistry
(2009)
65
A divergent strategy to the withasomnines.
RS Foster, J Huang, JF Vivat, DL Browne, JPA Harrity
Organic and Biomolecular Chemistry
(2009)
7
Evidence for heterogeneous Sonogashira coupling of phenylacetylene and iodobenzene catalyzed by well defined rhodium nanoparticles.
VK Kanuru, SM Humphrey, JMW Kyffin, DA Jefferson, JW Burton, M Armbrüster, RM Lambert
Dalton Trans
(2009)
Imaging Amyloid Fibrils within Cells Using a Se-Labelling Strategy
AE Porter, TPJ Knowles, K Muller, S Meehan, E McGuire, J Skepper, ME Welland, CM Dobson
J Mol Biol
(2009)
392
Ferromagnetism in Co-doped (La,Sr)TiO3
T Fix, M Liberati, H Aubriet, S-L Sahonta, R Bali, C Becker, D Ruch, JL MacManus-Driscoll, E Arenholz, MG Blamire
New Journal of Physics
(2009)
11
Further development of a genetic algorithm for ligand docking and its application to screening combinatorial libraries
G Jones, P Willett, RC Glen, AR Leach, R Taylor
ACS Symposium Series
(2009)
719
Optical response of a chiral liquid
AD Buckingham, P Fischer
ACS Symposium Series
(2009)
810
Sum-frequency generation at second order in isotropic chiral systems: The microscopic view and the surprising fragility of the signal
J Kirkwood, AC Albrecht, P Fischer, AD Buckingham
ACS Symposium Series
(2009)
810
Anomeric and Gauche Effects
AJ Kirby, NH Williams
ANOMERIC EFFECT AND ASSOCIATED STEREOELECTRONIC EFFECTS
(2009)
539
MATERIALS SCIENCE Soft particles feel the squeeze
D Frenkel
Nature
(2009)
460
The accessory subunit of mitochondrial DNA polymerase γ determines the DNA content of mitochondrial nucleoids in human cultured cells
M Di Re, H Sembongi, J He, A Reyes, T Yasukawa, P Martinsson, LJ Bailey, S Goffart, JD Boyd-Kirkup, TS Wong, AR Fersht, JN Spelbrink, IJ Holt
Nucleic Acids Res
(2009)
37
To Switch or Not To Switch: The Effects of Potassium and Sodium Ions on alpha-Poly-L-glutamate Conformations in Aqueous Solutions
MV Fedorov, JM Goodman, S Schumm
J Am Chem Soc
(2009)
131
Conformational changes of trialanine in sodium halide solutions: An in silico study
MV Fedorov, JM Goodman, VV Kolombet, S Schumm, IM Socorro
Journal of Molecular Liquids
(2009)
147
Conformationally rigid nucleoside probes help understand the role of sugar pucker and nucleobase orientation in the thrombin-binding aptamer
H Saneyoshi, S Mazzini, A Aviñó, G Portella, C González, M Orozco, VE Marquez, R Eritja
Nucleic acids research
(2009)
37
Optimum excitation of “enhanced” central transition populations
NM Trease, KK Dey, PJ Grandinetti
J Magn Reson
(2009)
200
Mechanism of compositional modulations in epitaxial InAlN films grown by molecular beam epitaxy
S-L Sahonta, GP Dimitrakopulos, T Kehagias, J Kioseoglou, A Adikimenakis, E Iliopoulos, A Georgakilas, H Kirmse, W Neumann, P Komninou
Applied Physics Letters
(2009)
95
Lithiation of N-alkyl-(o-tolyl)aziridine: stereoselective synthesis of isochromans.
M Dammacco, L Degennaro, S Florio, R Luisi, B Musio, A Altomare
The Journal of Organic Chemistry
(2009)
74