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- Currently displaying 12361 - 12380 of 30170 publications
The Use of Chlorobenzene as a Probe Molecule in Molecular Dynamics Simulations
Journal of Chemical Information and Modeling
(2014)
54
1821
(doi: 10.1021/ci500215x)
Density-matrix quantum Monte Carlo method
Physical Review B
(2014)
89
245124
(doi: 10.1103/PhysRevB.89.245124)
Heterogeneous reaction of N2O5 with airborne TiO2 particles and its implication for stratospheric particle injection
Atmospheric Chemistry and Physics
(2014)
14
6035
(doi: 10.5194/acp-14-6035-2014)
Metal‐Free Annulation of Arenes with 2‐Aminopyridine Derivatives: The Methyl Group as a Traceless Non‐Chelating Directing Group
Angewandte Chemie International Edition
(2014)
53
8163
(doi: 10.1002/anie.201403712)
Apportionment of urban aerosol sources in Cork (Ireland) by synergistic measurement techniques
The Science of the total environment
(2014)
493
197
Metallfreie Anellierung von Arenen mit 2‐Aminopyridin‐Derivaten: die Methylgruppe als spurlose nichtchelatisierende dirigierende Gruppe
Angewandte Chemie
(2014)
126
8302
(doi: 10.1002/ange.201403712)
Statistical mechanics of the denatured state of a protein using replica-averaged metadynamics.
Journal of the American Chemical Society
(2014)
136
8982
(doi: 10.1021/ja5027584)
Efficient Host-Guest Energy Transfer in Polycationic Cyclophane-Perylene Diimide Complexes in Water
J Am Chem Soc
(2014)
136
9053
(doi: 10.1021/ja5032437)
Differences in nucleation behavior underlie the contrasting aggregation kinetics of the Aβ40 and Aβ42 peptides.
Proceedings of the National Academy of Sciences of the United States of America
(2014)
111
9384
(doi: 10.1073/pnas.1401564111)
The H50Q mutation enhances α-synuclein aggregation, secretion, and toxicity.
J Biol Chem
(2014)
289
21856
(doi: 10.1074/jbc.m114.553297)
13C-labelled microdialysis studies of cerebral metabolism in TBI patients
European Journal of Pharmaceutical Sciences
(2014)
57
87
(doi: 10.1016/j.ejps.2013.12.012)
The effect of atomic ions on model σ-hole bonded complexes of AH3Y (A = C, Si, Ge; Y = F, Cl, Br)
Physical chemistry chemical physics : PCCP
(2014)
16
10854
(doi: 10.1039/c4cp01074d)
Certification and the potential energy landscape.
J Chem Phys
(2014)
140
224114
(doi: 10.1063/1.4881638)
Compilation and evaluation of gas-phase diffusion coefficients of inorganic reactive trace gases in the atmosphere
Atmospheric Chemistry and Physics Discussions
(2014)
14
15645
(doi: 10.5194/acpd-14-15645-2014)
Potential energy landscape of the two-dimensional XY model: Higher-index stationary points
J Chem Phys
(2014)
140
224503
(doi: 10.1063/1.4880417)
Cu-Catalyzed cascades to carbocycles: Union of diaryliodonium salts with alkenes or alkynes exploiting remote carbocations
J Am Chem Soc
(2014)
136
8851
(doi: 10.1021/ja504361y)
Elucidating the mechanism of substrate recognition by the bacterial Hsp90 molecular chaperone
Journal of Molecular Biology
(2014)
426
2393
(doi: 10.1016/j.jmb.2014.04.001)
Copper(II) Sequentially Loads onto the N‑Terminal Amino Group of the Cellular Prion Protein before the Individual Octarepeats
Biochemistry
(2014)
53
3934
(doi: 10.1021/bi500643b)