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  • Currently displaying 18441 - 18460 of 30393 publications
Author(s)
Publication title
Journal Name
Publication year
Variance minimization of free energy estimates from optimized expanded ensembles.
FJ Martínez-Veracoechea, FA Escobedo
Journal of Physical Chemistry B
(2008)
112
Density Oscillations in a Nanoscale Water Film on Salt: Insight from Ab Initio Molecular Dynamics
L Liu, M Krack, A Michaelides
Journal of the American Chemical Society
(2008)
130
Localized surface plasmon resonance (LSPR) sensitivity of Au nanodot patterns to probe solvation effects in polyelectrolyte brushes
S Kim, N Cheng, J-R Jeong, S-G Jang, S-M Yang, WTS Huck
Chemical communications (Cambridge, England)
(2008)
Mercury and halogen emissions from Masaya and telica volcanoes, Nicaragua
MLI Witt, TA Mather, DM Pyle, A Aiuppa, E Bagnato, VI Tsanev
Journal of Geophysical Research: Solid Earth
(2008)
113
Protein structure prediction using basin-hopping.
MC Prentiss, DJ Wales, PG Wolynes
The Journal of chemical physics
(2008)
128
Capture of hydroxymethylene and its fast disappearance through tunnelling.
PR Schreiner, HP Reisenauer, FC Pickard, AC Simmonett, WD Allen, E Mátyus, AG Császár
Nature
(2008)
453
Theoretical study of the asymmetric conjugate alkenylation of enones catalyzed by binaphthols
RS Paton, JM Goodman, SC Pellegrinet
The Journal of organic chemistry
(2008)
73
Theoretical study of the mechanism of hantzsch ester hydrogenation of imines catalyzed by chiral BINOL-phosphoric acids.
L Simón, JM Goodman
J Am Chem Soc
(2008)
130
Cu(II)-catalyzed direct and site-selective arylation of indoles under mild conditions.
RJ Phipps, NP Grimster, MJ Gaunt
Journal of the American Chemical Society
(2008)
130
Variable-temperature O-17 NMR study of oxygen motion in the anionic conductor Bi26Mo10O69
L Holmes, L Peng, I Heinmaa, LA O’Dell, ME Smith, R-N Vannier, CP Grey
Chemistry of Materials
(2008)
20
Molecular dynamics simulations of membrane proteins.
PC Biggin, PJ Bond
Methods Mol Biol
(2008)
443
High resolution imaging using scanning ion conductance microscopy with improved distance feedback control
C Li, N Johnson, V Ostanin, A Shevchuk, L Ying, Y Korchev, D Klenerman
Progress in Natural Science: Materials International
(2008)
18
Template-assembled synthetic G-quartets (TASQs)
M Nikan, JC Sherman
Angewandte Chemie (International ed. in English)
(2008)
47
Conformational stability and folding mechanisms of dimeric proteins.
JAO Rumfeldt, C Galvagnion, KA Vassall, EM Meiering
Prog Biophys Mol Biol
(2008)
98
Metadynamic sampling of the free-energy landscapes of proteins coupled with a Monte Carlo algorithm
F Marini, C Camilloni, D Provasi, RA Broglia, G Tiana
Gene
(2008)
422
A stochastic method for the reconstruction of protein structures from one-dimensional structural profiles
K Wolff, M Vendruscolo, M Porto
Gene
(2008)
422
Knotted Fusion Proteins Reveal Unexpected Possibilities in Protein Folding
AL Mallam, SC Onuoha, JG Grossmann, SE Jackson
Molecular Cell
(2008)
30
Discovery of Nonsteroidal 17β-Hydroxysteroid Dehydrogenase 1 Inhibitors by Pharmacophore-Based Screening of Virtual Compound Libraries
D Schuster, LG Nashev, J Kirchmair, C Laggner, G Wolber, T Langer, A Odermatt
J Med Chem
(2008)
51
Investigation into the phosphorescence of a series of regioisomeric iridium(III) complexes
HA Bronstein, CE Finlayson, KR Kirov, RH Friend, CK Williams
Organometallics
(2008)
27
Geometric phase effects in resonance-mediated scattering: H+H-2(+) on its lowest triplet electronic state
JC Juanes-Marcos, AJC Varandas, SC Althorpe
The Journal of Chemical Physics
(2008)
128