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- Currently displaying 20161 - 20180 of 30236 publications
Forward Flux Sampling-type schemes for simulating rare events: Efficiency analysis
(2006)
Translocation boost protein-folding efficiency of double-barreled chaperonins
Biophys J
(2006)
90
3375
(doi: 10.1529/biophysj.105.074898)
Super-arrhenius diffusion in an undercooled binary Lennard-Jones liquid results from a quantifiable correlation effect
Physical Review Letters
(2006)
96
057802
Reactive Uptake of N2O5 by Aerosol Particles Containing Mixtures of Humic Acid and Ammonium Sulfate †
The Journal of Physical Chemistry A
(2006)
110
6986
(doi: 10.1021/jp0562678)
Enhancement of charge-transport characteristics in polymeric films using polymer brushes
Nano Lett
(2006)
6
573
(doi: 10.1021/nl051803t)
Sulfur, normally a poison, strongly promotes chemoselective catalytic hydrogenation: stereochemistry and reactivity of crotonaldehyde on clean and S-modified Cu(111)
Chemical communications (Cambridge, England)
(2006)
1283
(doi: 10.1039/b517154g)
Synthesis of Li1+αV3O8 via a gel precursor: Part II, from xerogel to the anhydrous material
Chemistry of Materials
(2006)
18
{629-636}
(doi: 10.1021/cm051508+)
Characterization of the organic composition of aerosols from Rondônia, Brazil, during the LBA-SMOCC 2002 experiment and its representation through model compounds
Atmospheric Chemistry and Physics
(2006)
6
375
(doi: 10.5194/acp-6-375-2006)
Core domain interactions in full-length p53 in solution.
Proceedings of the National Academy of Sciences
(2006)
103
2115
(doi: 10.1073/pnas.0511130103)
Solution structure of p53 core domain: Structural basis for its instability
Proceedings of the National Academy of Sciences of the United States of America
(2006)
103
2109
(doi: 10.1073/pnas.0510941103)
Equilibrium free energies from fast-switching trajectories with large time steps - art. no. 044113
The Journal of chemical physics
(2006)
124
044113
(doi: 10.1063/1.2162874)
Preparation of the neolignan natural product grossamide by a continuous-flow process
Synlett
(2006)
2006
427
(doi: 10.1055/s-2006-926244)
Characterizing Bitterness: Identification of Key Structural Features and Development of a Classification Model
Journal of Chemical Information and Modeling
(2006)
46
569
(doi: 10.1021/ci0504418)
Insertion and assembly of membrane proteins via simulation.
J Am Chem Soc
(2006)
128
2697
(doi: 10.1021/ja0569104)
Structural biology and bioinformatics in drug design: opportunities and challenges for target identification and lead discovery
Philosophical Transactions of the Royal Society B Biological Sciences
(2006)
361
413
(doi: 10.1098/rstb.2005.1800)
Mild aerobic oxidative palladium (II) catalyzed C-H bond functionalization: Regioselective and switchable C-H alkenylation and annulation of pyrroles
J Am Chem Soc
(2006)
128
2528
(doi: 10.1021/ja058141u)
Spin transitions in a dithiazolyl radical: preparation, crystal structures, and magnetic properties of 3-cyanobenzo-1,3,2-dithiazolyl, C7H3S2N2.
Inorganic Chemistry
(2006)
45
1903
(doi: 10.1021/ic051935p)
Diode laser spectroscopy of the nu(2) fundamental band of cis-HOPO
Journal of Molecular Spectroscopy
(2006)
235
248
(doi: 10.1016/j.jms.2005.11.013)
Simulation of single-file ion transport with the lattice Fokker-Planck equation
Phys Rev E Stat Nonlin Soft Matter Phys
(2006)
73
017701
(doi: 10.1103/physreve.73.017701)
Synthesis of Zinc, Copper, Nickel, Cobalt, and Iron Complexes Using Tris(pyrazolyl)methane Sulfonate Ligands: A Structural Model for N,N,O Binding in Metalloenzymes
Inorganic chemistry
(2006)
45
2242
(doi: 10.1021/ic051579a)
