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- Currently displaying 20041 - 20060 of 30136 publications
Theory of C2Hx species on Pt{110}(1 x 2): Structure, stability, and thermal chemistry
The journal of physical chemistry. B
(2006)
110
4147
(doi: 10.1021/jp055128n)
Thermodynamically self-consistent liquid state theories for systems with bounded potentials
The Journal of Chemical Physics
(2006)
124
64503
(doi: 10.1063/1.2167646)
Harvesting chemical information from the Internet using a distributed approach: ChemXtreme
Journal of chemical information and modeling
(2006)
46
452
(doi: 10.1021/ci050329+)
Translocation boost protein-folding efficiency of double-barreled chaperonins
Biophysical Journal
(2006)
90
3375
(doi: 10.1529/biophysj.105.074898)
Forward Flux Sampling-type schemes for simulating rare events: Efficiency analysis
(2006)
Probing the Mechanism of Amyloidogenesis through a Tandem Repeat of the PI3-SH3 Domain Suggests a Generic Model for Protein Aggregation and Fibril Formation
Journal of molecular biology
(2006)
356
189
(doi: 10.1016/j.jmb.2005.11.034)
Enhancement of charge-transport characteristics in polymeric films using polymer brushes.
Nano Lett
(2006)
6
573
(doi: 10.1021/nl051803t)
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)
Super-Arrhenius diffusion in an undercooled binary Lennard-Jones liquid results from a quantifiable correlation effect.
Phys Rev Lett
(2006)
96
057802
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)
Sulfur, normally a poison, strongly promotes chemoselective catalytic hydrogenation: stereochemistry and reactivity of crotonaldehyde on clean and S-modified Cu(111).
Chem Commun (Camb)
(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+)
Solution structure of p53 core domain: structural basis for its instability.
Proceedings of the National Academy of Sciences
(2006)
103
2109
(doi: 10.1073/pnas.0510941103)
Core domain interactions in full-length p53 in solution
Proceedings of the National Academy of Sciences
(2006)
103
2115
(doi: 10.1073/pnas.0511130103)
Preparation of the Neolignan Natural Product Grossamide by a Continuous-Flow Process
Synlett
(2006)
2006
427
(doi: 10.1055/s-2006-926244)
Equilibrium free energies from fast-switching trajectories with large time steps
The Journal of chemical physics
(2006)
124
044113
(doi: 10.1063/1.21652874)
Insertion and Assembly of Membrane Proteins via Simulation
Journal of the American Chemical Society
(2006)
128
2697
(doi: 10.1021/ja0569104)
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)
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
Journal of the American Chemical Society
(2006)
128
2528
(doi: 10.1021/ja058141u)
