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- Currently displaying 18501 - 18520 of 29659 publications
Simulating ice nucleation, one molecule at a time, with the ‘DFT microscope’
Faraday Discuss
(2007)
136
287
(doi: 10.1039/b616689j)
Cocrystal architecture and properties: design and building of chiral and racemic structures by solid–solid reactions
Faraday Discuss
(2007)
136
167
(doi: 10.1039/b616399h)
Interactions of 4-Chlorophenol with TiO2 Polycrystalline Surfaces: A Study of Environmental Interfaces by NEXAFS, XPS, and UPS
Langmuir
(2007)
23
9551
(doi: 10.1021/la7012792)
Comparative biophysical characterization of p53 with the pro-apoptotic BAK and the anti-apoptotic BCL-x(L)
J Biol Chem
(2007)
282
29193
(doi: 10.1074/jbc.M705544200)
Total synthesis of (-)-reidispongiolide A, an actin-targeting marine macrolide.
Angewandte Chemie International Edition
(2007)
46
6167
(doi: 10.1002/anie.200702178)
The glass transition temperatures of amorphous trehalose-water mixtures and the mobility of water: an experimental and in silico study
Carbohydrate Research
(2007)
342
1470
(doi: 10.1016/j.carres.2007.04.01)
CAESAR: A New Conformer Generation Algorithm Based on Recursive Buildup and Local Rotational Symmetry Consideration
Journal of Chemical Information and Modeling
(2007)
47
1923
(doi: 10.1021/ci700136x)
Chiral glycolate equivalents for the asymmetric synthesis of alpha-hydroxycarbonyl compounds
Bulletin of the Chemical Society of Japan
(2007)
80
1451
(doi: 10.1246/bcsj.80.1451)
Car-Parrinello and path integral molecular dynamics study of the hydrogen bond in the chloroacetic acid dimer system.
The Journal of Chemical Physics
(2007)
127
064304
(doi: 10.1063/1.2749251)
Organic Synthesis in Water: 1,3‐Dipolar Cycloaddition Reactions at Ambient Temperature with Aqueous Suspensions of Solid Reactants.
ChemInform
(2007)
38
no
(doi: 10.1002/chin.200735153)
Furanyl spiroketals as stereochemical relays in the synthesis of 1,9-anti diols: synthesis of insect pheromones
Tetrahedron Letters
(2007)
48
5683
(doi: 10.1016/j.tetlet.2007.06.004)
Preparation of Cyclobis(paraquat‐p‐phenylene)‐Based [2]Rotaxanes Without Flexible Glycol Chains
Angewandte Chemie
(2007)
119
6205
(doi: 10.1002/ange.200701722)
Preparation of cyclobis(paraquat-p-phenylene)-based [2]rotaxanes without flexible glycol chains
Angewandte Chemie International Edition
(2007)
46
6093
(doi: 10.1002/anie.200701722)
Host-guest binding constants can be estimated directly from the product distributions of dynamic combinatorial libraries
Angew Chem Int Ed Engl
(2007)
46
5762
(doi: 10.1002/anie.200700292)
Density functional theory study of flat and stepped NaCl(001)
Physical Review B Condensed Matter and Materials Physics
(2007)
76
075401
(doi: 10.1103/physrevb.76.075401)
Controlling viscoelastic flow by tuning frequency during occlusions
Physical Review E Statistical Nonlinear and Soft Matter Physics
(2007)
76
(doi: 10.1103/PhysRevE.76.026301)
Local structure of liquid carbon controls diamond nucleation.
Physical Review Letters
(2007)
99
055702
Structures and solution dynamics of pseudorotaxanes mediated by alkali-metal cations.
Dalton Trans
(2007)
3874
(doi: 10.1039/b706043b)
Database guided conformation selection in crystal structure prediction of alanine
CrystEngComm
(2007)
9
595
(doi: 10.1039/b702136d)
