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- Currently displaying 20561 - 20580 of 29849 publications
The generation of misfit dislocations in facet-controlled growth of AlGaN∕GaN films
Applied Physics Letters
(2004)
85
4923
(doi: 10.1063/1.1825051)
Improving numerical integration through basis set expansion
Theoretical Chemistry Accounts
(2004)
112
410
(doi: 10.1007/s00214-004-0613-0)
Effect of salt bridges on the energy landscape of a model protein.
The Journal of Chemical Physics
(2004)
121
10284-10290
(doi: 10.1063/1.1810471)
Calculation of nuclear magnetic resonance shielding constants using potential-based methods
Chemical Physics Letters
(2004)
399
84
(doi: 10.1016/j.cplett.2004.09.112)
Representation and use of chemistry in the global electronic age
Organic and Biomolecular Chemistry
(2004)
2
3192
(doi: 10.1039/b410732b)
Open access and the Chemical Semantic Web.
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2004)
229
U601
Metal–carbon bond energies for adsorbed hydrocarbons from calorimetric data
Surface Science
(2004)
572
179
(doi: 10.1016/j.susc.2004.08.015)
One-state downhill versus conventional protein folding.
Journal of Molecular Biology
(2004)
344
295
(doi: 10.1016/j.jmb.2004.09.069)
Selection of a Pentameric Host in the Host–Guest Complexes {[{[P(μ‐NtBu)]2(μ‐NH)}5]⋅I}−[Li(thf)4]+ and [{[P(μ‐NtBu)]2(μ‐NH)}5]⋅HBr⋅THF
Chemistry
(2004)
10
6066
(doi: 10.1002/chem.200400320)
MD Simulations of Spontaneous Membrane Protein/Detergent Micelle Formation
Journal of the American Chemical Society
(2004)
126
15948
(doi: 10.1021/ja044819e)
Preparation of enantiopure butane-2,3-diacetals of glycolic acid and alkylation reactions leading to alpha-hydroxyacid and amide derivatives
Organic and Biomolecular Chemistry
(2004)
2
3608
(doi: 10.1039/b412788a)
Studies on the generation of enolate anions from butane-2,3-diacetal protected glycolic acid derivatives and subsequent highly diastereoselective coupling reactions with aldehydes and acid chlorides.
Org Biomol Chem
(2004)
2
3618
(doi: 10.1029/b412790k)
Atomic vibrations in disordered systems: Comparison of disordered diamond lattices and a realistic amorphous silicon model
physica status solidi (c)
(2004)
1
2904
(doi: 10.1002/pssc.200405362)
Molecular surface point environments for virtual screening and the elucidation of binding patterns (MOLPRINT 3D).
Journal of medicinal chemistry
(2004)
47
6569
(doi: 10.1021/jm049611i)
Water-soluble hydroxyalkylated phosphines: Examples of their differing behaviour toward ruthenium and rhodium
Dalton Trans
(2004)
4202
(doi: 10.1039/b411701h)
A molecular dynamics simulation of the melting points and glass transition temperatures of myo- and neo-inositol.
Journal of Chemical Physics
(2004)
121
9565
(doi: 10.1063/1.1806792)
The folding of spectrin domains I: wild-type domains have the same stability but very different kinetic properties.
Journal of Molecular Biology
(2004)
344
195
(doi: 10.1016/j.jmb.2004.09.037)
A Test for Homology: Photoactive Crystalline Assemblies Involving Linear Templates Based on a Homologous Series of Phloroglucinols
Organic letters
(2004)
6
4647
(doi: 10.1021/ol0484052)
The Folding of Spectrin Domains II: Phi-value Analysis of R16
J Mol Biol
(2004)
344
207
(doi: 10.1016/j.jmb.2004.09.023)
Origins of helix-coil switching in a light-sensitive peptide.
Biochemistry
(2004)
43
15329
(doi: 10.1021/bi048152k)
