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- Currently displaying 19161 - 19180 of 30298 publications
Why do ultrasoft repulsive particles cluster and crystallize? Analytical results from density-functional theory.
The Journal of Chemical Physics
(2007)
126
224502
(doi: 10.1063/1.2738064)
The folding pathway of an FF domain:: Characterization of an on-pathway intermediate state under folding conditions by 15N, 13Cα and 13C-methyl relaxation dispersion and 1H/2 H-exchange NMR Spectroscopy
Journal of Molecular Biology
(2007)
372
497
(doi: 10.1016/j.jmb.2007.06.012)
Experiments suggest that simulations may overestimate electrostatic contributions to the mechanical stability of a fibronectin type III domain
J Mol Biol
(2007)
371
851
(doi: 10.1016/j.jmb.2007.06.015)
Hydrogen-bonded cubanes and ladder fragments by analogy with the inorganic solid state.
Chem Commun (Camb)
(2007)
3273
(doi: 10.1039/b706422e)
Explanation for the Apparent Absence of Collapse of Polyelectrolyte Brushes in the Presence of Bulky Ions
The journal of physical chemistry. B
(2007)
111
7034
(doi: 10.1021/jp071026g)
Single molecule pulling with large time steps
Physical Review E
(2007)
75
061106
(doi: 10.1103/physreve.75.061106)
Outer membrane proteins: comparing X-ray and NMR structures by MD simulations in lipid bilayers
European biophysics journal : EBJ
(2007)
37
131
(doi: 10.1007/s00249-007-0185-8)
Designing an extracellular matrix protein with enhanced mechanical stability.
Proc Natl Acad Sci U S A
(2007)
104
9633
(doi: 10.1073/pnas.0609901104)
Protein structure determination from NMR chemical shifts.
Proceedings of the National Academy of Sciences of the United States of America
(2007)
104
9615
(doi: 10.1073/pnas.0610313104)
Evaluation of ⟨Ŝ2⟩ in density functional theory
The Journal of Chemical Physics
(2007)
126
214104
(doi: 10.1063/1.2737773)
Structural surface investigations of cerium-zirconium mixed oxide nanocrystals with enhanced reducibility
The Journal of Physical Chemistry C
(2007)
111
9001
(doi: 10.1021/jp072466a)
OmpA: Gating and dynamics via molecular dynamics simulations
Biochimica et Biophysica Acta
(2007)
1778
1871
(doi: 10.1016/j.bbamem.2007.05.024)
Structural control of dithiazolyl radicals:: Case studies on 3′- and 4′-cyano-benzo-1,3,2-dithiazolyl, NCC6H3S2N
Journal of Organometallic Chemistry
(2007)
692
2750
New synthetic pathways into dithiazolyl radicals: Preparation and characterisation of 3′-methyl-benzo-1,3,2-dithiazolyl, M'BDTA
Journal of Organometallic Chemistry
(2007)
692
2743
Cyclophosphazenes tethered together via N-ring centres with ortho-, meta- and para-xylylene linkers
Journal of Organometallic Chemistry
(2007)
692
2768
Synthesis and catalytic properties in olefin epoxidation of dioxomolybdenum(vi) complexes bearing a bidentate or tetradentate salen-type ligand
Molecular Catalysis
(2007)
270
185
Comparison between reflectance/emittance spectra of iron-containing minerals
Proceedings of the 3rd International Conference on Recent Advances in Space Technologies Rast 2007
(2007)
4
252
(doi: 10.1109/RAST.2007.4283988)
Pattern formation during the oxidation of CO on Pt{100}: a mesoscopic model.
Phys Rev Lett
(2007)
98
226102
Pharmaceutical Strategy and Innovation: An Academics Perspective
ChemMedChem
(2007)
2
768
(doi: 10.1002/cmdc.200700008)
Analysis of pharmacology data and the prediction of adverse drug reactions and off-target effects from chemical structure.
ChemMedChem
(2007)
2
861
(doi: 10.1002/cmdc.200700026)
