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- Currently displaying 20521 - 20540 of 29281 publications
Density-functional generalized-gradient and hybrid calculations of electromagnetic properties using Slater basis sets.
The Journal of Chemical Physics
(2004)
120
7252
(doi: 10.1063/1.1668633)
Decarboxylative elimination of enol triflates as a general synthesis of acetylenes.
Org Biomol Chem
(2004)
2
1504
(doi: 10.1039/b401435a)
Probing local and long-range structure simultaneously: An in situ study of the high-temperature phase transition of alpha-AlF3
Journal of the American Chemical Society
(2004)
126
{4756-4757}
(doi: 10.1021/ja031553n)
Thermodynamic/kinetic control in the isomerization of the [{tBuNP(μ-NtBu)}2]2- ion
Chemistry
(2004)
10
2271
(doi: 10.1002/chem.200305762)
Electrochemical and structural properties of xLi2M′O 3·(1-x)LiMn0.5Ni0.5O2 electrodes for lithium batteries (M′ = Ti, Mn, Zr; O ≤ x ≤ 0.3)
Chemistry of Materials
(2004)
16
1996
(doi: 10.1021/cm0306461)
Demonstration of a low-energy on-pathway intermediate in a fast-folding protein by kinetics, protein engineering, and simulation.
Proc Natl Acad Sci U S A
(2004)
101
6450
(doi: 10.1073/pnas.0401732101)
Transition states for protein folding have native topologies despite high structural variability
Nat Struct Mol Biol
(2004)
11
443
(doi: 10.1038/nsmb765)
Exploring sequence/folding space: folding studies on multiple hydrophobic core mutants of ubiquitin.
Biochemistry
(2004)
43
5195
(doi: 10.1021/bi0361620)
Diethyl 2,5-bis(triisopropylsilylethynyl)terephthalate
Acta Crystallographica Section E Structure Reports Online
(2004)
60
o784
(doi: 10.1107/S1600536804008311)
Local and global cooperativity in the human alpha-lactalbumin molten globule
Journal of Molecular Biology
(2004)
338
149
(doi: 10.1016/j.jmb.2004.02.045)
Targeting the single-strand G-rich overhang of telomeres with PNA inhibits cell growth and induces apoptosis of human immortal cells
Exp Cell Res
(2004)
295
204
(doi: 10.1016/j.yexcr.2004.01.003)
The effects of ageing a bimetallic catalyst under industrial conditions: A study of fresh and used Pd-Au-K/silica vinyl acetate synthesis catalysts
Applied Catalysis A General
(2004)
261
37
(doi: 10.1016/j.apcata.2003.10.032)
Theory of Methane Dehydrogenation on Pt{110}(1 × 2). Part I: Chemisorption of CHx(x= 0 −3)
Journal of Physical Chemistry B
(2004)
108
5909
(doi: 10.1021/jp037880z)
Broadband femtosecond sum-frequency spectroscopy of CO on Ru{10(1)over-bar0} in the frequency and time domains
The Journal of Chemical Physics
(2004)
120
7158
(doi: 10.1063/1.1669377)
Theory of methane dehydrogenation on pt{110}(1 × 2). Part ii: Microscopic reaction pathways for chx → Chx-1 (x = 1-3)
Journal of Physical Chemistry B
(2004)
108
5920
(doi: 10.1021/jp037881r)
Rotational Motion of Alkanes on Zeolite ZK-5 Studied from 1H−13C NMR Cross-Relaxation
The Journal of Physical Chemistry B
(2004)
108
5600
(doi: 10.1021/jp0354447)
Three-dimensional structures of translating ribosomes by Cryo-EM
Mol Cell
(2004)
14
57
Structural motifs in secondary ammonium halides: ring-stacking and ring-laddering in the organic solid state.
Chemistry
(2004)
10
1885
(doi: 10.1002/chem.200305700)
Controlling chemoselectivity in the lithiation of substituted aromatic tertiary amides.
Angewandte Chemie International Edition
(2004)
43
2135
(doi: 10.1002/anie.200353324)
