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Concanavalin A in a dimeric crystal form: revisiting structural accuracy and molecular flexibility

Katherine A. Kantardjieff、Peter Höchtl、Brent W. Segelke 等 5 位作者2002-04-26Acta Crystallographica Section D Biological Crystallography

A structure of native concanavalin A (ConA), a hardy perennial of structural biology, has been determined in a dimeric crystal form at a resolution of 1.56 A (space group C222(1); unit-cell parameters a = 118.70, b = 101.38, c = 111.97 A; two molecules in the asymmetric unit). The structure has been refined to an R(fr…

Protein Structure and DynamicsProtein purification and stabilityEnzyme Structure and Function

Folding and Conformational Consequences of Glycine to Alanine Replacements at Different Positions in a Collagen Model Peptide

Manjiri Bhate、Xin Wang、Jean Baum 等 4 位作者2002-04-26Biochemistry

The collagen model peptide T1-892 includes a C-terminal nucleation domain, (Gly-Pro-Hyp)(4), and an N-terminal (Gly-X-Y)(6) sequence taken from type I collagen. In osteogenesis imperfecta (OI) and other collagen diseases, single base mutations often convert one Gly to a larger residue, and T1-892 homologues modeling s…

Connective tissue disorders researchCollagen: Extraction and Characterization

Structural relaxation in a system of dumbbell molecules

Song‐Ho Chong、W. Götze2002-04-26Physical review. E, Statistical physics, plasmas, fluids, and related interdisciplinary topics

The interaction-site-density-fluctuation correlators, the dipole-relaxation functions, and the mean-squared displacements of a system of symmetric dumbbells of fused hard spheres are calculated for two representative elongations of the molecules within the mode-coupling theory for the evolution of glassy dynamics. For…

Material Dynamics and PropertiesThermodynamic properties of mixturesSpectroscopy and Quantum Chemical Studies

Heteropoly acid as a novel efficient catalyst for Fries rearrangement

Elena F. Kozhevnikova、Éric G. Derouane、Ivan V. Kozhevnikov2002-04-26Chemical Communications

Heteropoly acid H3PW12O40 is a very efficient and environmentally benign catalyst for the Fries rearrangement of phenyl acetate in homogeneous or heterogeneous liquid-phase systems at 100-150 degrees C.

Polyoxometalates: Synthesis and ApplicationsChemical Synthesis and ReactionsChemical Synthesis and Characterization

Thermodynamics of Pure-Silica Molecular Sieve Synthesis

Sanyuan Yang、Alexandra Navrotsky、Mark E. Davis2002-04-26The Journal of Physical Chemistry B

ADVERTISEMENT RETURN TO ISSUEPREVAddition/CorrectionORIGINAL ARTICLEThis notice is a correctionThermodynamics of Pure-Silica Molecular Sieve SynthesisSanyuan Yang, Alexandra Navrotsky, and Mark E. DavisCite this: J. Phys. Chem. B 2002, 106, 20, 5312Publication Date (Web):April 26, 2002Publication History Published onl…

Zeolite Catalysis and SynthesisMesoporous Materials and CatalysisCatalysis and Oxidation Reactions

Cathodic Electrochemical Detection of Sonochemical Radical Products

Peter R. Birkin、J. Power、T.G. Leighton 等 4 位作者2002-04-26Analytical Chemistry

This paper reports on an electrochemical technique for the detection of oxidizing radical species, produced as the result of cavitation induced by ultrasound. A study of two example reactions is reported: the Weissler reaction and the Fricke reaction. In both cases, redox-active materials trap oxidative radicals. Elec…

Advanced Chemical Sensor TechnologiesUltrasound and Cavitation PhenomenaRadiation Effects and Dosimetry

Layer-by-layer depositions of polyelectrolyte/CdTe nanocrystal films controlled by electric fields

Junqi Sun、Mingyuan Gao、Min Zhu 等 5 位作者2002-04-26Journal of Materials Chemistry

Electric fields are used to control the layer-by-layer deposition of positively charged poly(diallyldimethylammonium chloride) (PDDA) and negatively charged CdTe nanocrystals on Au substrates following the method of ‘Electric Field Directed Layer-by-layer Assembly’ (EFDLA) described in . Experimental results demonstra…

Quantum Dots Synthesis And PropertiesPolymer Surface Interaction StudiesMolecular Junctions and Nanostructures

Properties of silica‐filled styrene‐butadiene rubber compounds containing acrylonitrile‐butadiene rubber: The influence of the acrylonitrile‐butadiene rubber type

Sung‐Seen Choi2002-04-26Journal of Applied Polymer Science

Abstract Because silica has strong filler‐filler interactions and adsorbs polar materials, a silica‐filled rubber compound exhibits poor dispersion of the filler and poor cure characteristics in comparison with those of a carbon black‐filled rubber compound. Acrylonitrile‐butadiene rubber (NBR) improves filler dispers…

Polymer Nanocomposites and PropertiesSynthesis and properties of polymersSilicone and Siloxane Chemistry

Growing Monodispersed PbS Nanoparticles on Self-Assembled Monolayers of 11-Mercaptoundecanoic Acid on Au(111) Substrate

Peng Jiang、Zhongfan Liu、Shengmin Cai2002-04-26Langmuir

Lead sulfide, PbS, nanoparticles with the average size of 3.2 ± 0.4 nm have been synthesized by exposing self-assembled monolayers (SAMs) of 11-mercaptoundecanoic acid adsorbed Pb 2+ ions on Au(111) substrate into a H 2 S atmosphere. The preparation process of the PbS nanoparticles consists of the formation of the SAM…

Quantum Dots Synthesis And PropertiesChalcogenide Semiconductor Thin FilmsMolecular Junctions and Nanostructures

Coherent versus incoherent interlayer transport in layered metals

J. Wosnitza、J. Hagel、J. S. Qualls 等 11 位作者2002-04-26Physical review. B, Condensed matter

The magnetic-field, temperature, and angular dependence of the interlayer magnetoresistance of two different quasi-two-dimensional (2D) organic superconductors is reported. For $\ensuremath{\kappa}\ensuremath{-}(\mathrm{BEDT}\ensuremath{-}\mathrm{TTF}{)}_{2}{\mathrm{I}}_{3},$ where BEDT-TTF is bisethylenedithio-tetrat…

Physics of Superconductivity and MagnetismQuantum and electron transport phenomenaOrganic and Molecular Conductors Research

Formation of Au Nanoclusters on TiO2 Surfaces by a Two-Step Method Consisting of Au(III)-Complex Chemisorption and Its Photoreduction

Tetsuro Soejima、Hiroaki Tada、Tetsuro Kawahara 等 4 位作者2002-04-26Langmuir

The aim of this study is to prepare Au clusters with a mean size ( d ) of less than 3.0 nm, at which nonmetallic properties can be expected to appear. Au clusters ( d < 3.0 nm) have been formed rapidly (<2 min) on TiO 2 surfaces by a two-step method consisting of Au(III)-complex chemisorption and subsequent photoreduc…

Gold and Silver Nanoparticles Synthesis and ApplicationsCatalytic Processes in Materials ScienceNanocluster Synthesis and Applications

Mechanical and morphological properties of white rice husk ash filled polypropylene/ethylene‐propylene‐diene terpolymer thermoplastic elastomer composites

S. Siriwardena、H. Ismail、U. S. Ishiaku 等 4 位作者2002-04-26Journal of Applied Polymer Science

Abstract The performance of white rice husk ash (WRHA) as filler for polypropylene (PP)/ethylene‐propylene‐diene terpolymer (EPDM) thermoplastic elastomer (TPE) composites was investigated. The composites with different filler loadings were prepared in a Brabender plasticorder internal mixer. Both unvulcanized and dyn…

Polymer crystallization and propertiesPolymer Nanocomposites and PropertiesNatural Fiber Reinforced Composites

Real-space rigid-unit-mode analysis of dynamic disorder in quartz, cristobalite and amorphous silica

Stephen A. Wells、Martin T. Dove、Matthew G. Tucker 等 4 位作者2002-04-26Journal of Physics Condensed Matter

We use a recently developed tool based on geometric algebra to analyse the phase transition in quartz, the nature of the disordered high-temperature phase of cristobalite and the dynamics of silica glass. The approach is to analyse configurations generated by the reverse Monte Carlo or molecular dynamics simulations i…

High-pressure geophysics and materialsGlass properties and applicationsSolid-state spectroscopy and crystallography

Simulated-annealing real-space refinement as a tool in model building

А.A. Коростелев、Richard Bertram、Michael S. Chapman2002-04-26Acta Crystallographica Section D Biological Crystallography

Methods have been developed that further automate the building of macromolecular structures into electron-density maps. The software supports molecular-dynamics real-space refinement of an atomic model to local regions of a map within the context of a popular molecular-modeling program, O [Jones et al. (1991), Acta Cr…

Advanced Chemical Physics StudiesProtein Structure and DynamicsEnzyme Structure and Function

Self-Assembly of a Lamellar ABC Triblock Copolymer Thin Film

Kenji Fukunaga、Takeji Hashimoto、Hubert Elbs 等 4 位作者2002-04-26Macromolecules

We study the self-assembly in thin films of a lamella-forming polystyrene- block -poly(2-vinylpyridine)- block -poly( tert -butyl methacrylate) triblock copolymer by means of scanning force microscopy (SFM) and cross-sectional transmission electron microscopy (TEM). We follow the time development of the microdomain st…

Polymer Surface Interaction StudiesBlock Copolymer Self-AssemblyFluid Dynamics and Thin Films

EPR studies of the effect ofZn2+ion impurities in phase transition ofCaCd(CH3COO)4⋅6H2Ocrystals

D. K. De2002-04-26Physical review. B, Condensed matter

The effect of ${\mathrm{Zn}}^{2+}$ ion impurities on the phase transition temperature of single crystals of calcium cadmium acetate hexahydrate (CCDAH) has been studied using the electron-paramagnetic-resonance technique. The lowering of the phase transition temperature as a function of increasing ${\mathrm{Zn}}^{2+}$…

Crystal structures of chemical compoundsSolid-state spectroscopy and crystallographyElectron Spin Resonance Studies

Engineering Reactions in Crystalline Solids: Predicting Photochemical Decarbonylation from Calculated Thermochemical Parameters

Luis M. Campos、Hung Dang、Danny Ng 等 6 位作者2002-04-26The Journal of Organic Chemistry

A detailed thermochemical analysis of the alpha-cleavage and decarbonylation reactions of acetone and several ketodiesters was carried out with the B3LYP/6-31G* density functional method. The heats of formation of several ground-state ketones and radicals were calculated at 298 K to determine bond dissociation energie…

Thermal and Kinetic AnalysisChemical Thermodynamics and Molecular StructureChemistry and Chemical Engineering

Preparation and characteristics of NR/EPDM rubber blends

S. H. Botros2002-04-26Polymer-Plastics Technology and Engineering

Ethylene propylene diene monomer rubber (EPDM) was modified with maleic anhydride (MA). Benzoyl peroxide was used as an initiator. Then the produced MA-EPDM was mixed with natural rubber (NR)/EPDM blends with various compositions. The scanning electron micrographs demonstrated that the addition of MA-EPDM (10 phr) imp…

Polymer crystallization and propertiesPolymer Nanocomposites and PropertiesTribology and Wear Analysis

FIP: a highly automated beamline for multiwavelength anomalous diffraction experiments

M. Roth、Philippe Carpentier、O. Kaı̈kati 等 13 位作者2002-04-26Acta Crystallographica Section D Biological Crystallography

FIP is a French Collaborating Research Group (CRG) beamline at the European Synchrotron Radiation Facility (ESRF) dedicated exclusively to crystallography of biological macromolecules, with a special emphasis on multiwavelength anomalous diffraction data collection in the 0.7-1.81 A wavelength range. The optics, consi…

Protein Structure and DynamicsEnzyme Structure and FunctionMolecular spectroscopy and chirality

Rearrangement of Cruickshank's formulae for the diffraction-component precision index

D. M. Blow2002-04-26Acta Crystallographica Section D Biological Crystallography

The formulae for the diffraction-component precision index introduced by Cruickshank [(1999), Acta Cryst. D55, 583-601] are simplified using two approximations. A rearranged formula for the precision index is presented which can readily be calculated from experimental data. It is shown that the precision varies as (re…

Enzyme Structure and FunctionCultural Heritage Materials AnalysisX-ray Diffraction in Crystallography