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- Currently displaying 20481 - 20500 of 29386 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
(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‘O3·(1−x)LiMn0.5Ni0.5O2 Electrodes for Lithium Batteries (M‘ = Ti, Mn, Zr; 0 ≤ 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.
– Proceedings of the National Academy of Sciences
(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)
Diethyl 2,5-bis(triisopropylsilylethynyl)-terephthalate
– Acta Crystallographica Section E: Crystallographic Communications
(2004)
60,
o784
(doi: 10.1107/S1600536804008311)
Exploring Sequence/Folding Space: Folding Studies on Multiple Hydrophobic Core Mutants of Ubiquitin † , ‡
– Biochemistry
(2004)
43,
5195
(doi: 10.1021/bi0361620)
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)
Theory of Methane Dehydrogenation on Pt{110}(1 × 2). Part I: Chemisorption of CH x (x = 0 −3)
– The Journal of Physical Chemistry B
(2004)
108,
5909
(doi: 10.1021/jp037880z)
Broadband femtosecond sum-frequency spectroscopy of CO on Ru1010 in the frequency and time domains.
– Journal of Chemical Physics
(2004)
120,
7158
(doi: 10.1063/1.1669377)
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)
Theory of Methane Dehydrogenation on Pt{110}(1 × 2). Part II: Microscopic Reaction Pathways for CH x → CH x - 1 (x = 1−3)
– The Journal of Physical Chemistry B
(2004)
108,
5920
(doi: 10.1021/jp037881r)
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)
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
– Molecular Cell
(2004)
14,
57
Structural motifs in secondary ammonium halides: ring-stacking and ring-laddering in the organic solid state.
– Chemistry - A European Journal
(2004)
10,
1885
(doi: 10.1002/chem.200305700)
Controlling chemoselectivity in the lithiation of substituted aromatic tertiary amides.
– Angew Chem Int Ed Engl
(2004)
43,
2135
(doi: 10.1002/anie.200353324)
Testing protein-folding simulations by experiment: B domain of protein A
– Proc Natl Acad Sci U S A
(2004)
101,
6952
(doi: 10.1073/pnas.0401396101)