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Accurate reconstruction of all-atom protein representations from side-chain-based low-resolution models

Michael Feig、Piotr Rotkiewicz、Andrzej Koliński 等 5 位作者2000-01-01Proteins Structure Function and Bioinformatics

A procedure for the reconstruction of all-atom protein structures from side-chain center-based low-resolution models is introduced and applied to a set of test proteins with high-resolution X-ray structures. The accuracy of the rebuilt all-atom models is measured by root mean square deviations to the corresponding X-r…

Protein Structure and DynamicsRNA and protein synthesis mechanismsEnzyme Structure and Function

Design of molecular materials combining magnetic, electrical and optical properties †

Eugenio Coronado、Miguel Clemente‐León、José Ramón Galán‐Mascarós 等 6 位作者2000-01-01Journal of the Chemical Society Dalton Transactions

The possibilities offered by hybrid functional materials formed by two molecular networks in the context of crystal engineering are illustrated with two different examples: (i) hybrid magnets constructed from combination of an extended ferromagnetic or ferrimagnetic inorganic network, with a molecular paramagnetic met…

Magnetism in coordination complexesPolyoxometalates: Synthesis and ApplicationsOrganic and Molecular Conductors Research

Self assembled nanoparticulate Co:Pt for data storage applications

B. Warne、O. I. Kasyutich、Eric Mayes 等 5 位作者2000-01-01IEEE Transactions on Magnetics

Nanoscale CoPt grains were prepared within protein shells from aqueous reactants. A series of particles with varying Co:Pt ratios was used to explore the transition from superparamagnetic to ferromagnetic behavior at room temperature. TEM and electron diffraction confirmed ordered fct CoPt phases with an average grain…

Magnetic properties of thin filmsQuantum Dots Synthesis And PropertiesMolecular Junctions and Nanostructures

Characterization of Boron-Incorporated Zinc Oxide Film Chemically Prepared from an Aqueous Solution

Masanobu Izaki、Jun‐ichi Katayama2000-01-01Journal of The Electrochemical Society

Boron‐incorporated ZnO film which had a wurtzite structure and showed optical bandgap energy of 3.3 eV was prepared chemically onto a nonconductive substrate by immersing the substrate in an aqueous solution containing a zinc nitrate and dimethylamineborane (DMAB) at 333 K. Effects of the incorporated boron on the str…

ZnO doping and propertiesQuantum Dots Synthesis And PropertiesConducting polymers and applications

Nylon 11/silica nanocomposite coatings applied by the HVOF process. II. Mechanical and barrier properties

E. Petrovicova、Richard Knight、Linda S. Schadler 等 4 位作者2000-01-01Journal of Applied Polymer Science

Nylon 11 coatings filled with nominal 0–15 vol % of nanosized silica or carbon black were produced using the high velocity oxy-fuel combustion spray process. The scratch and sliding wear resistance, mechanical, and barrier properties of nanocomposite coatings were measured. The effect of powder initial size, filler co…

Polymer Nanocomposites and PropertiesSilicone and Siloxane ChemistryMaterial Properties and Applications

Magnetic Field-Induced Martensitic Transformation and Giant Magnetostriction in Fe&ndash;Ni&ndash;Co&ndash;Ti and Ordered Fe<SUB>3</SUB>Pt Shape Memory Alloys

Tomoyuki Kakeshita、Tetsuya Takeuchi、Takashi Fukuda 等 7 位作者2000-01-01Materials Transactions JIM

The effect of a magnetic field on martensitic transformations in Fe–Ni–Co–Ti and Fe3Pt shape memory alloys has been examined in order to know a magnetic field-induced martensitic transformation and a control of crystallographic domain (variant) by magnetic field. Following results were obtained: (i) Magnetoelastic mar…

Microstructure and Mechanical Properties of SteelsShape Memory Alloy TransformationsMagnetic Properties and Applications

Highly oriented 3D-hexagonal silica thin films produced with cetyltrimethylammonium bromide

David Grosso、Ruud Balkenende、P. A. Albouy 等 6 位作者2000-01-01Journal of Materials Chemistry

Mesoporous silica thin films have been produced by sol–gel chemistry in the presence of cetyltrimethylammonium bromide (CTAB) template. The films were deposited on silicon or glass substrates by dip-coating and underwent different treatments to eliminate the CTAB and create porosity. As-prepared and treated coatings e…

Mesoporous Materials and CatalysisAerogels and thermal insulationSilicone and Siloxane Chemistry

Intermediate Temperature Solid Oxide Fuel Cells Using LaGaO[sub 3] Electrolyte II. Improvement of Oxide Ion Conductivity and Power Density by Doping Fe for Ga Site of LaGaO[sub 3]

Tatsumi Ishihara、Takaaki Shibayama、Miho Honda 等 5 位作者2000-01-01Journal of The Electrochemical Society

Effects of small amounts of Fe doping for Ga site in oxide on oxide ion conductivity is investigated in this study. It is found that doping a small amount of Fe is effective for improving the oxide ion conductivity in (LSGM). The highest oxide ion conductivity was exhibited at x = 0.03 in among the Fe‐doped samples. E…

Advancements in Solid Oxide Fuel CellsFuel Cells and Related MaterialsChemical Looping and Thermochemical Processes

Formation of Mesoporous Silica Nanotubes

Hong‐Ping Lin、Chung‐Yuan Mou、S.-B. Liu2000-01-01Advanced Materials

Mesoporous silica ropes and pillar-within-hollow gyroidal spheres with highly ordered nanostructure have been synthesized through acid and ammonia hydrothermal treatment. Along with hierarchical structures, mesoporous tubules and myelin fingers, such as that shown in the Figure, spontaneously form from the silica rope…

Mesoporous Materials and CatalysisDiatoms and Algae Research

Structure and imperfections in amorphous and crystalline silicon dioxide

R. A. B. Devine、J. P. Duraud、E. Dooryhée2000-01-01OpenAlex

Contributors Preface Part I Topological Models for the Crystalline and Amorphous Phases (a) Description of the Atomic Arrangement in SiO-2 Polymorphs Chapter 1 The Topology of Silica Networks (by L. W. Hobbs, C. E. Jesurum and B. Berger) Chapter 2 Low-Pressure Crystalline Phases of SiO-2 (by G. Dolino) Chapter 3 Theor…

Glass properties and applicationsThin-Film Transistor TechnologiesSilicon Nanostructures and Photoluminescence

New nanocomposites: putting organic function “inside” the channel walls of periodic mesoporous silica

Tewodros Asefa、Chiaki Yoshina‐Ishii、Mark J. MacLachlan 等 4 位作者2000-01-01Journal of Materials Chemistry

Nature's accomplishments are inspiring chemists to design new materials based on biologically formed organic and inorganic structures that have been optimized over evolutionary timescales. A recent breakthrough in biomimetic materials chemistry has seen the fusion of organic and inorganic chemistry within the channel…

Mesoporous Materials and CatalysisPolyoxometalates: Synthesis and ApplicationsDiatoms and Algae Research

Inorganic crystal engineering: a personal perspective

Dario Braga2000-01-01Journal of the Chemical Society Dalton Transactions

Inorganic crystal engineering is the modelling, synthesis and evaluation of the properties of crystalline materials obtained from inorganic, organometallic and bioinorganic building blocks. This article will take the reader across this interdisciplinary field of research from supramolecular to materials chemistry and…

Crystallography and molecular interactionsCrystal Structures and PropertiesX-ray Diffraction in Crystallography

Immunolabeling for Electron Microscopy

Catherine Sarraf2000-01-01Methods in molecular medicine

The protocols in this chapter concern postembedding immunolabeling for transmission electron microscopy; other schedules, such as pre-embedding methods, frozen tissue processes, and procedures for scanning electron microscopy, can be found elsewhere (1). In principle, immunolabeling at the electron microscope (EM) lev…

Advanced Electron Microscopy Techniques and ApplicationsElectron and X-Ray Spectroscopy Techniques

On the mechanism of compatibilization of polyolefin/liquid crystalline polymer blends with graft copolymers

Francesco Paolo La Mantia、Roberto Scaffaro、P. L. Magagnini 等 4 位作者2000-01-01Journal of Applied Polymer Science

The compatibilization mechanism of some compatibilizers for blends of polyolefins with a liquid crystalline polymer (LCP) was studied. Polyethylene (PE) and polypropylene (PP) were blended with a semirigid LCP (SBH) in a batch mixer, either with and without compatibilizers. The latter were two commercially available s…

Polymer crystallization and propertiesPolymer Nanocomposites and Propertiesbiodegradable polymer synthesis and properties

On the origin of ferroelectricity in PbTiO3

A. V. Turik、A. G. Khasabov2000-01-01Ferroelectrics

The effective Born charges and ionic displacements in the ferroelectric phase have been used for estimations of relative contributions of different ion sublattices into the value of the spontaneous polarization of ABO3 ferroelectric oxides with perovskite-type structure. The principal difference of PbTiO3 from other p…

Ferroelectric and Piezoelectric MaterialsPhotorefractive and Nonlinear OpticsSolid-state spectroscopy and crystallography

Raman scattering and x-ray diffraction studies of rare earth-doped Pb0.90La0.15TiO3 thin films prepared by the sol-gel method

P. S. Dobal、R. R. Das、Biplab Roy 等 6 位作者2000-01-01Journal of Raman Spectroscopy

The structural modification and phase transition in rare earth (Gd3+ and Ce3+)-doped Pb0.90La0.15TiO3 films, prepared by the sol–gel technique on Pt substrates, were studied utilizing x-ray diffraction and micro-Raman scattering techniques. Lattice parameters calculated from x-ray data indicate an increase in lattice…

Ferroelectric and Piezoelectric MaterialsPhotorefractive and Nonlinear OpticsAcoustic Wave Resonator Technologies

Ionic thermoplastic elastomer based on the zinc salt of sulfonated maleated EPDM rubber. II. Reinforcement by fillers

Swapan K. Ghosh、P. P. De、Dipak Khastgir 等 4 位作者2000-01-01Journal of Applied Polymer Science

Incorporation of SRF and ISAF grades of carbon black and precipitated silica improves the physical properties of the zinc stearate plasticized ionomer, namely, the zinc salt of sulfonated maleated EPDM rubber, which behaves as an ionic thermoplastic elastomer. The reinforcing ability of the fillers follows the order S…

Polymer Nanocomposites and PropertiesAnalytical Chemistry and SensorsDielectric materials and actuators

Micro-Raman spectroscopy of Pd-B/SiO2 amorphous alloy catalyst

Guihua Wang、Xibin Yu、Xiaowei Cao 等 5 位作者2000-01-01Journal of Raman Spectroscopy

Multi-channel confocal micro-Raman spectroscopy was used to characterize silica-supported PdCl2 powder (PdCl2/SiO2) and Pd–B amorphous alloy catalyst (Pd–B/SiO2) which is formed by reducing PdCl2/SiO2 with KBH4. The results show that PdCl2/SiO2 gives mainly a complicated broad ν(PdCl) bands in the 150–650 cm−1 region…

Advanced Photocatalysis TechniquesLuminescence Properties of Advanced MaterialsCatalytic Processes in Materials Science

10.51847/XRbRWoJ

Mashail Al-Ghamdi、Magda M. Aly、Reda M. Sheshtawi2000-01-01Time to knit

Resistance to antibiotics is increased in all hospitals, and bacterial pathogens that contaminate burns and wounds are widespread. Their resistance to well-known antibiotics is recorded, and every day resistant isolates are counted and studied. The present study aimed to prepare new polymers with antimicrobial activit…

Nanocomposite Films for Food Packaging

Compatibility studies of sulfonated poly(ether ether ketone)-poly(ether imide)-polycarbonate ternary blends

Yong Sung Chun、Hyun Sung Kwon、Woo Nyon Kim 等 4 位作者2000-01-01Journal of Applied Polymer Science

Binary blends of the sulfonated poly(ether ether ketone) (SPEEK)–poly(ether imide) (PEI) and SPEEK–polycarbonate (PC), and ternary blends of the SPEEK–PEI–PC, were investigated by differential scanning calorimetry. SPEEK was obtained by sulfonation of poly(ether ether ketone) using 95% sulfuric acid. From the thermal…

Polymer Nanocomposites and PropertiesAdvanced Physical and Chemical Molecular InteractionsSynthesis and properties of polymers