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- Currently displaying 18041 - 18060 of 29898 publications
Fractional charge perspective on the band gap in density-functional theory
Physical Review B
(2008)
77
115123
(doi: 10.1103/physrevb.77.115123)
Size extensivity of the direct optimized effective potential method
The Journal of Chemical Physics
(2008)
128
114702
(doi: 10.1063/1.2877129)
Implicit Solvent Models and the Energy Landscape for Aggregation of the Amyloidogenic KFFE Peptide
J Chem Theory Comput
(2008)
4
657
(doi: 10.1021/ct700305w)
The symmetry group of nonrigid tetramethylsilane
International Journal of Quantum Chemistry
(2008)
108
1410
(doi: 10.1002/qua.21654)
Synthesis and structure of the Li13 cage [{[O-P(μ-NtBu)]2Li2}3(LiCl)6Li(Cl/OnBu)0.5(thf)7], containing a [O-P(μ-NtBu)]22- dianion
Chemical Communications
(2008)
2251
(doi: 10.1039/b800051d)
Urea and Guanidinium Chloride Denature Protein L in Different Ways in Molecular Dynamics Simulations
Biophys J
(2008)
94
4654
(doi: 10.1529/biophysj.107.125799)
Bayesian inference for improved single molecule fluorescence tracking.
Biophysical journal
(2008)
94
4932
(doi: 10.1529/biophysj.107.116285)
Hydrophobic solvation of Gay–Berne particles in modified water models
The Journal of chemical physics
(2008)
128
104506
(doi: 10.1063/1.2837289)
An electrophysiological and behavioural study of insect antifeedant properties of natural and synthetic drimane-related compounds.
Physiological Entomology
(2008)
12
281
Azide monoliths as convenient flow reactors for efficient Curtius rearrangement reactions
Organic & Biomolecular Chemistry
(2008)
6
1587
(doi: 10.1039/b801634h)
A modular flow reactor for performing Curtius rearrangements as a continuous flow process.
Organic and Biomolecular Chemistry
(2008)
6
1577
(doi: 10.1039/b801631n)
The degree of structural protection at the edge beta-strands determines the pathway of amyloid formation in globular proteins.
J Am Chem Soc
(2008)
130
4295
(doi: 10.1021/ja076628s)
Fluorine magnetic resonance in vivo: a powerful tool in the study of drug distribution and metabolism.
Drug Discov Today
(2008)
13
473
(doi: 10.1016/j.drudis.2007.12.011)
Ordered assemblies of clay nano-platelets
Bioinspiration & biomimetics
(2008)
3
016005
(doi: 10.1088/1748-3182/3/1/016005)
Efficient prediction of thermodynamic properties of quadrupolar fluids from simulation of a coarse-grained model: the case of carbon dioxide.
Journal of Chemical Physics
(2008)
128
104501
(doi: 10.1063/1.2837291)
Dipole amplification: a principle for the self-assembly of asymmetric monomers on metal surfaces.
Angew Chem Int Ed Engl
(2008)
47
2422
(doi: 10.1002/anie.200704172)
Facile, one-step production of niacin (vitamin B3) and other nitrogen-containing pharmaceutical chemicals with a single-site heterogeneous catalyst
Chemistry A European Journal
(2008)
14
2340
(doi: 10.1002/chem.200701679)
Poly[[aqua-μ3-picolinato-μ2-picolinato-dipicolinatopotassium(I)terbium(III)] 2.5-hydrate]
Acta crystallographica. Section E, Structure reports online
(2008)
64
M529
(doi: 10.1107/s1600536808005758)
Synthesis of (+)-Obtusenyne
Chemistry (Weinheim an der Bergstrasse, Germany)
(2008)
14
2867
(doi: 10.1002/chem.200701567)