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- Currently displaying 16121 - 16140 of 31159 publications
The fourth age of quantum chemistry: molecules in motion.
Phys. Chem. Chem. Phys.
(2011)
14
1085
(doi: 10.1039/c1cp21830a)
Fast Resonance Assignment and Fold Determination of Human Superoxide Dismutase by High‐Resolution Proton‐Detected Solid‐State MAS NMR Spectroscopy
Angewandte Chemie International Edition
(2011)
50
11697
(doi: 10.1002/anie.201106340)
Defects in doped LaGaO3 anionic conductors: Linking NMR spectral features, local environments, and defect thermodynamics
J Am Chem Soc
(2011)
133
17662
(doi: 10.1021/ja2053557)
Stereoselective Synthesis of Sarmentine
Russian Journal of General Chemistry
(2011)
81
1915
(doi: 10.1134/S1070363211090337)
Mode-Specific Chemisorption of CH4 on Pt{110}-(1 x 2) Explored by First-Principles Molecular Dynamics
Journal of Physical Chemistry C
(2011)
115
21832
(doi: 10.1021/jp207746q)
Amphiphile replacement on carbon nanotube surfaces: Effect of aromatic groups on the interaction strength
Physica Status Solidi B Basic Research
(2011)
248
2532
(doi: 10.1002/pssb.201100515)
Inversion of the Balance between Hydrophobic and Hydrogen Bonding Interactions in Protein Folding and Aggregation
PLoS Comput Biol
(2011)
7
e1002169
(doi: 10.1371/journal.pcbi.1002169)
Irreversible High-Temperature Hydrogen Interaction with the Metal Organic Framework Cu 3 (BTC) 2
The Journal of Physical Chemistry C
(2011)
115
21521
(doi: 10.1021/jp206821f)
Aryl–Aryl Bond Formation by the Fluoride‐Free Cross‐Coupling of Aryldisiloxanes with Aryl Bromides
Chemistry
(2011)
17
13230
(doi: 10.1002/chem.201102285)
"Cofactor"-controlled enantioselective catalysis.
Journal of the American Chemical Society
(2011)
133
17176
(doi: 10.1021/ja208589c)
pH-Driven dynamic stereoinduction: epimerization upon dimerization in rhenium(I) complexes.
Chem Commun (Camb)
(2011)
47
12765
(doi: 10.1039/c1cc14799d)
Single crystal nuclear magnetic resonance in spinning powders
J Chem Phys
(2011)
135
144201
(doi: 10.1063/1.3640418)
Extended surfaces modulate hydrophobic interactions of neighboring solutes
Proceedings of the National Academy of Sciences
(2011)
108
17678
(doi: 10.1073/pnas.1110703108)
The solid-liquid interface free-energy of Pb: comparison of theory and experiments.
Journal of Physics: Condensed Matter
(2011)
23
435008
The Continuous-Flow Synthesis of Styrenes Using Ethylene in a Palladium-Catalysed Heck Cross-Coupling Reaction
Synlett
(2011)
2011
2643
(doi: 10.1055/s-0031-1289291)
Syngas-mediated C-C bond formation in flow: Selective rhodium-catalysed hydroformylation of styrenes
Synlett
(2011)
2011
2648
(doi: 10.1055/s-0031-1289292)
Energy landscapes of colloidal clusters: thermodynamics and rearrangement mechanisms.
Nanoscale
(2011)
4
1085
(doi: 10.1039/c1nr10679a)
The Effect of Linker Histone's Nucleosome Binding Affinity on Chromatin Unfolding Mechanisms
Biophysical Journal
(2011)
101
1670
(doi: 10.1016/j.bpj.2011.07.044)
Some comments on topological approaches to the π-electron currents in conjugated systems
J Chem Theory Comput
(2011)
7
3661
(doi: 10.1021/ct2002539)
Thermodynamic Properties of Water Molecules at a Protein Protein Interaction Surface
Journal of Chemical Theory and Computation
(2011)
7
3514
(doi: 10.1021/ct200465z)