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- Currently displaying 15121 - 15140 of 31163 publications
Application of inhomogeneous fluid solvation theory to model the distribution and thermodynamics of water molecules around biomolecules
Phys Chem Chem Phys
(2012)
14
15106
(doi: 10.1039/c2cp42631e)
A state-to-state dynamical study of the Br + H2 reaction: comparison of quantum and classical trajectory results
Phys Chem Chem Phys
(2012)
14
13067
(doi: 10.1039/c2cp41825h)
Spin-transfer pathways in paramagnetic lithium transition-metal phosphates from combined broadband isotropic solid-state MAS NMR spectroscopy and DFT calculations.
J Am Chem Soc
(2012)
134
17178
(doi: 10.1021/ja306876u)
A Highly Compliant Protein Native State with a Spontaneous-like Mechanical Unfolding Pathway
Journal of the American Chemical Society
(2012)
134
17068
(doi: 10.1021/ja305862m)
Taming the First-Row Diatomics: A Full Configuration Interaction Quantum Monte Carlo Study.
J Chem Theory Comput
(2012)
8
4138
(doi: 10.1021/ct300504f)
Selective RNA Versus DNA G‐Quadruplex Targeting by In Situ Click Chemistry
Angewandte Chemie (International ed. in English)
(2012)
51
11073
(doi: 10.1002/anie.201206281)
Dual template synthesis of a highly mesoporous SSZ-13 zeolite with improved stability in the methanol-to- olefins reaction
Chemical communications (Cambridge, England)
(2012)
48
9492
(doi: 10.1039/c2cc33994c)
Lithocholic acid is an endogenous inhibitor of MDM4 and MDM2
Proceedings of the National Academy of Sciences
(2012)
109
16906
(doi: 10.1073/pnas.1215060109)
Salt Anions Promote the Conversion of HypF-N into Amyloid-Like Oligomers and Modulate the Structure of the Oligomers and the Monomeric Precursor State
Journal of molecular biology
(2012)
424
132
(doi: 10.1016/j.jmb.2012.09.023)
Improved description of soft layered materials with van der Waals density functional theory
Journal of Physics Condensed Matter
(2012)
24
424216
Sulfate-Selective Binding and Sensing of a Fluorescent [3]Rotaxane Host System
Chemistry – A European Journal
(2012)
18
14406
(doi: 10.1002/chem.201202204)
Electron Transfer in Dye-Sensitised Semiconductors Modified with Molecular Cobalt Catalysts: Photoreduction of Aqueous Protons
Chemistry
(2012)
18
15464
(doi: 10.1002/chem.201202149)
Building on architectural principles for three-dimensional metallosupramolecular construction
Chem Soc Rev
(2012)
42
1728
(doi: 10.1039/c2cs35254k)
Development of a sensitive long path absorption photometer to quantify peroxides in aerosol particles (Peroxide-LOPAP)
Atmospheric Measurement Techniques
(2012)
5
2339
(doi: 10.5194/amt-5-2339-2012)
Absolute acidity of clay edge sites from ab-initio simulations
Geochimica et Cosmochimica Acta
(2012)
94
1
(doi: 10.1016/j.gca.2012.07.010)
Microwave-assisted Cu-catalyzed Ullmann ether synthesis in a continuous-flow milli-plant
Chemical Engineering Journal
(2012)
207-208
426
(doi: 10.1016/j.cej.2012.06.147)
Discovery of a novel allosteric mechanism for the regulation of HCV NS3/4a protein function present across all genotypes
HEPATOLOGY
(2012)
56
707A
Applications of quantum cascade lasers in plasma diagnostics: A review
Journal of Physics D
(2012)
45
423001
Modified high performance concentric nebulizer for inductively coupled plasma optical emission spectrometry
Journal of Analytical Atomic Spectrometry
(2012)
27
1787
(doi: 10.1039/c2ja30118k)
Tunability of structure from ordered to disordered and its impact on ionic conductivity behavior in the Nd2-yHoyZr2O7 (0.0 ≤ y ≤ 2.0) system
RSC Advances
(2012)
2
8341
(doi: 10.1039/c2ra20458d)