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- Currently displaying 18281 - 18300 of 30215 publications
Variance minimization of free energy estimates from optimized expanded ensembles
The journal of physical chemistry. B
(2008)
112
8120
(doi: 10.1021/jp801688p)
Mercury and halogen emissions from Masaya and Telica volcanoes, Nicaragua
Journal of Geophysical Research Solid Earth
(2008)
113
B06203
(doi: 10.1029/2007JB005401)
Density oscillations in a nanoscale water film on salt: Insight from ab initio molecular dynamics
Journal of the American Chemical Society
(2008)
130
8572
(doi: 10.1021/ja8014296)
Localized surface plasmon resonance (LSPR) sensitivity of Au nanodot patterns to probe solvation effects in polyelectrolyte brushes.
Chem Commun (Camb)
(2008)
3666
(doi: 10.1039/b805684f)
Protein structure prediction using basin-hopping.
Journal of Chemical Physics
(2008)
128
225106
(doi: 10.1063/1.2929833)
Capture of hydroxymethylene and its fast disappearance through tunnelling.
Nature
(2008)
453
906
(doi: 10.1038/nature07010)
Cu(II)-Catalyzed direct and site-selective arylation of indoles under mild conditions
J Am Chem Soc
(2008)
130
8172
(doi: 10.1021/ja801767s)
Theoretical study of the mechanism of hantzsch ester hydrogenation of imines catalyzed by chiral BINOL-phosphoric acids.
Journal of the American Chemical Society
(2008)
130
{8741-8747}
(doi: 10.1021/ja800793t)
Theoretical study of the asymmetric conjugate alkenylation of enones catalyzed by binaphthols.
J Org Chem
(2008)
73
5078
(doi: 10.1021/jo8007463)
Variable-temperature 17O NMR study of oxygen motion in the anionic conductor Bi26Mo10O69
Chemistry of Materials
(2008)
20
3638
(doi: 10.1021/cm800351c)
Molecular Dynamics Simulations of Membrane Proteins
Methods in molecular biology (Clifton, N.J.)
(2008)
443
147
(doi: 10.1007/978-1-59745-177-2_8)
Template-assembled synthetic G-quartets (TASQs)
Angewandte Chemie International Edition
(2008)
47
4900
(doi: 10.1002/anie.200704199)
Conformational stability and folding mechanisms of dimeric proteins.
Progress in Biophysics and Molecular Biology
(2008)
98
61
Knotted fusion proteins reveal unexpected possibilities in protein folding
Molecular cell
(2008)
30
642
(doi: 10.1016/j.molcel.2008.03.019)
A stochastic method for the reconstruction of protein structures from one-dimensional structural profiles
Gene
(2008)
422
47
(doi: 10.1016/j.gene.2008.06.004)
Metadynamic sampling of the free-energy landscapes of proteins coupled with a Monte Carlo algorithm
Gene
(2008)
422
37
(doi: 10.1016/j.gene.2008.06.003)
Discovery of Nonsteroidal 17β-Hydroxysteroid Dehydrogenase 1 Inhibitors by Pharmacophore-Based Screening of Virtual Compound Libraries
J Med Chem
(2008)
51
4188
(doi: 10.1021/jm800054h)
Investigation into the Phosphorescence of a Series of Regioisomeric Iridium(III) Complexes
Organometallics
(2008)
27
2980
(doi: 10.1021/om800014e)
Geometric phase effects in resonance-mediated scattering: H+ H2+ on its lowest triplet electronic state
Journal of Chemical Physics
(2008)
128
211101
(doi: 10.1063/1.2936829)
G-quadruplex recognition by bis-indole carboxamides
Chemical communications (Cambridge, England)
(2008)
3055
(doi: 10.1039/b806042h)