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- Currently displaying 18281 - 18300 of 29535 publications
Gas-sorption selectivity of CUK-1: A porous coordination solid made of cobalt(II) and pyridine-2,4-dicarboxylic acid
– Advanced Materials
(2007)
19,
1830
(doi: 10.1002/adma.200601983)
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)
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)
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/2H-exchange NMR Spectroscopy
– Journal of molecular biology
(2007)
372,
497
(doi: 10.1016/j.jmb.2007.06.012)
Hydrogen-bonded cubanes and ladder fragments by analogy with the inorganic solid state.
– Chemical Communications
(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 Statistical Nonlinear and Soft Matter Physics
(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
(2007)
37,
131
(doi: 10.1007/s00249-007-0185-8)
Evaluation of ⟨S2⟩ in density functional theory
– Journal of Chemical Physics
(2007)
126,
214104
(doi: 10.1063/1.2737773)
OmpA: gating and dynamics via molecular dynamics simulations.
– Biochim Biophys Acta
(2007)
1778,
1871
(doi: 10.1016/j.bbamem.2007.05.024)
Structural surface investigations of cerium-zirconium mixed oxide nanocrystals with enhanced reducibility
– Journal of Physical Chemistry C
(2007)
111,
9001
(doi: 10.1021/jp072466a)
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 dioxomolybdenurn(VI) complexes bearing a bidentate or tetradentate salen-type ligand
– Molecular Catalysis
(2007)
270,
185
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
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)
Modeling promiscuity based on in vitro safety pharmacology profiling data
– Chemmedchem
(2007)
2,
874
(doi: 10.1002/cmdc.200700036)
Pharmaceutical Strategy and Innovation: An Academics Perspective
– Chemmedchem
(2007)
2,
768
(doi: 10.1002/cmdc.200700008)
Kinetics and thermodynamics of amyloid formation from direct measurements of fluctuations in fibril mass.
– Proc Natl Acad Sci U S A
(2007)
104,
10016
(doi: 10.1073/pnas.0610659104)
Pattern Formation during the Oxidation of CO on Pt{100}: A Mesoscopic Model
– Physical Review Letters
(2007)
98,
226102