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Crystal structure analysis of a fatty acid double-bond hydratase fromLactobacillus acidophilus

Anton Volkov、Sohail Khoshnevis、Piotr Neumann 等 7 位作者2013-03-13Acta Crystallographica Section D Biological Crystallography

Bacteria have evolved mechanisms for the hydrogenation of unsaturated fatty acids. Hydroxy fatty acid formation may be the first step in such a process; however, knowledge of the structural and mechanistic aspects of this reaction is scarce. Recently, myosin cross-reactive antigen was shown to be a bacterial FAD-conta…

Enzyme Structure and FunctionPolyamine Metabolism and ApplicationsAmino Acid Enzymes and Metabolism

In Situ Synthesis and Nonvolatile Rewritable‐Memory Effect of Polyaniline‐Functionalized Graphene Oxide

Bin Zhang、Yu Chen、Yujie Ren 等 9 位作者2013-03-13Chemistry - A European Journal

A new polyaniline (PANI)-functionalized graphene oxide (GO-PANI) was prepared by using an in situ oxidative graft polymerization of aniline on the surface of GO. Its highest occupied molecular orbital (HOMO), lowest unoccupied molecular orbital (LUMO), ionization potential (IP), and electron affinity (EA) values exper…

Supercapacitor Materials and FabricationElectrochemical sensors and biosensorsConducting polymers and applications

Adsorption and Reaction of Methanol over CeO X (100) Thin Films

P. Albrecht、David R. Mullins2013-03-13Langmuir

Methanol was adsorbed on oxidized and reduced CeOX(100) thin films to probe the active sites and reaction selectivity of these surfaces compared to those of CeOX(111). Roughly twice as much methoxy was formed on oxidized CeO2(100) compared to that formed on CeO2(111). In addition to more methoxy, hydroxyl is also more…

Catalytic Processes in Materials ScienceCatalysis and Hydrodesulfurization StudiesCatalysis and Oxidation Reactions

Influence of Gas Phase Equilibria on the Chemical Vapor Deposition of Graphene

Amanda M. Lewis、Brian Derby、Ian A. Kinloch2013-03-13ACS Nano

We have investigated the influence of gas phase chemistry on the chemical vapor deposition of graphene in a hot wall reactor. A new extended parameter space for graphene growth was defined through literature review and experimentation at low pressures (≥0.001 mbar). The deposited films were characterized by scanning e…

Carbon Nanotubes in CompositesGraphene research and applicationsRadiation Effects in Electronics

Visual automated macromolecular model building

Gerrit G. Langer、S. Hazledine、Tim Wiegels 等 5 位作者2013-03-13Acta Crystallographica Section D Biological Crystallography

Automated model-building software aims at the objective interpretation of crystallographic diffraction data by means of the construction or completion of macromolecular models. Automated methods have rapidly gained in popularity as they are easy to use and generate reproducible and consistent results. However, the pro…

Microbial Metabolic Engineering and BioproductionEnzyme Structure and Function

Superconductivity with extremely large upper critical fields in Nb2Pd0.81S5

Q. Zhang、Gang Li、Daniel Rhodes 等 10 位作者2013-03-13Scientific Reports

Here, we report the discovery of superconductivity in a new transition metal-chalcogenide compound, i.e. Nb2Pd0.81S5, with a transition temperature Tc is approximately equal to 6.6 K. Despite its relatively low Tc, it displays remarkably high and anisotropic superconducting upper critical fields, e.g. μ0Hc2 (T → 0 K)…

Physics of Superconductivity and MagnetismRare-earth and actinide compoundsIron-based superconductors research

Skyrmion dynamics in multiferroic insulators

Ye-Hua Liu、You‐Quan Li、Jung Hoon Han2013-03-13Physical Review B

The recent discovery of a Skyrmion crystal phase in an insulating multiferroic compound Cu${}_{2}$OSeO${}_{3}$ calls for new ways and ideas to manipulate the Skyrmions in the absence of spin transfer torque from the conduction electrons. It is shown here that the position-dependent electric field, pointed along the di…

Magnetic properties of thin filmsTheoretical and Computational PhysicsMultiferroics and related materials

Chitosan as a Smart Coating for Controlled Release of Corrosion Inhibitor 2-Mercaptobenzothiazole

Jorge Carneiro、João Tedim、Susana C. M. Fernandes 等 7 位作者2013-03-13ECS Electrochemistry Letters

An active protective coating based on chitosan (CTS) polymer with corrosion inhibitor 2-mercaptobenzothiazole (MBT) is reported. Structural and morphological analysis indicated that MBT is present in large amounts within the CTS matrix without affecting detrimentally the properties of CTS. More relevant, the release o…

Corrosion Behavior and InhibitionConducting polymers and applicationsConcrete Corrosion and Durability

Epitaxial Graphene and Graphene–Based Devices Studied by Electrical Scanning Probe Microscopy

Olga Kazakova、Vishal Panchal、Timothy L. Burnett2013-03-13Crystals

We present local electrical characterization of epitaxial graphene grown on both Si- and C-faces of 4H-SiC using Electrostatic Force Microscopy and Kelvin Probe Force Microscopy in ambient conditions and at elevated temperatures. These techniques provide a straightforward identification of graphene domains with variou…

Carbon Nanotubes in CompositesGraphene research and applicationsDiamond and Carbon-based Materials Research

Flexural Electromechanical Coupling: A Nanoscale Emergent Property of Boron Nitride Bilayers

Karel-Alexander N. Duerloo、Evan J. Reed2013-03-13Nano Letters

The symmetry properties of atomically thin boron nitride (BN) monolayers endow them with piezoelectric properties, whereas the bulk parent crystal of stacked BN layers is not piezoelectric. This suggests potential for unusual electromechanical properties in the few layer regime. In this work, we explore this regime an…

Graphene research and applications2D Materials and ApplicationsMechanical and Optical Resonators

Comparative study on the blends of PBS/thermoplastic starch prepared from waxy and normal corn starches

Jiwei Li、Xuegang Luo、Xiaoyan Lin 等 4 位作者2013-03-13Starch - Stärke

Abstract In this study, waxy (0% amylose) and normal (26% amylose) corn starches were used to prepare thermoplastic starch (WTPS and NTPS, respectively). Furthermore, comparative blends of poly (butylene succinate) (PBS) and WTPS and NTPS were prepared for investigating the effect of starch type and PBS content on the…

Nanocomposite Films for Food Packagingbiodegradable polymer synthesis and propertiesElectrospun Nanofibers in Biomedical Applications

Reduction of percolation threshold through double percolation in melt‐blended polycarbonate/acrylonitrile butadiene styrene/multiwall carbon nanotubes elastomer nanocomposites

Sandip Maiti、Nilesh K. Shrivastava、Bhanu Bhusan Khatua2013-03-13Polymer Composites

Abstract We demonstrate a method that involves melt blending of polycarbonate (PC) and melt‐blended acrylonitrile butadiene styrene (ABS) with multiwall carbon nanotubes (MWCNTs) to prepare electrically conducting PC/MWCNT nanocomposites at significantly low MWCNT loading. The partial solubility of ABS in PC led to a…

Carbon Nanotubes in CompositesPolymer Nanocomposites and PropertiesConducting polymers and applications

A ternary EAM interatomic potential for U–Mo alloys with xenon

Daria Smirnova、A. Yu. Kuksin、Sergey Starikov 等 7 位作者2013-03-13Modelling and Simulation in Materials Science and Engineering

A new interatomic potential for a uranium-molybdenum system with xenon is developed in the framework of an embedded atom model using a forcematching technique and a dataset of ab initio atomic forces.The verification of the potential proves that it is suitable for the investigation of various compounds existing in the…

Fusion materials and technologiesNuclear reactor physics and engineeringNuclear Materials and Properties

Versatile Fabrication of Nanocomposite Microcapsules with Controlled Shell Thickness and Low Permeability

Yu Yang、Zengjiang Wei、Chaoyang Wang 等 4 位作者2013-03-13ACS Applied Materials & Interfaces

Novel ethyl phenylacetate (EPA)-loaded nanocomposite microcapsules with polyurea (PU) /poly (melamine formaldehyde) (PMF) shells were facilely and fabricated: by using silica nanoparticle-stabilized oil-in-water (o/w) emulsion template and subsequent interfacial reaction and in situ polymerization. SiO2 nanoparticles…

Surface Modification and SuperhydrophobicityPolymer composites and self-healingPickering emulsions and particle stabilization

Structural and functional insight into the universal stress protein family

Karolina L. Tkaczuk、I.A. Shumilin、M. Chruszcz 等 6 位作者2013-03-13Evolutionary Applications

We present the crystal structures of two universal stress proteins (USP) from Archaeoglobus fulgidus and Nitrosomonas europaea in both apo- and ligand-bound forms. This work is the first complete synthesis of the structural properties of 26 USP available in the Protein Data Bank, over 75% of which were determined by s…

Genomics and Phylogenetic StudiesProtein Structure and DynamicsEnzyme Structure and Function

Synthesis and characterization of PVA/YBCO nanocomposite for improvement of solar energy conversion

W. Shirbeeny、M. Hafez、Waleed E. Mahmoud2013-03-13Polymer Composites

Abstract The development of nano‐metal oxide materials with unique optoelectronic properties such as highly solar energy absorption and generation of dense amount of electrons is one of the hottest topics now days. The incorporation of these nanomaterials into polymers results in an improvement of the properties of th…

Advancements in Battery MaterialsZnO doping and propertiesPolymer Nanocomposite Synthesis and Irradiation

Natural fiber blend—nylon 6 composites

Ertan Özen、Alper Kızıltaş、Esra Erbas Kiziltas 等 4 位作者2013-03-13Polymer Composites

Abstract In this study, engineering thermoplastic composites were prepared from natural fiber blend–filled nylon 6. Natural fiber blend from a mixture of kenaf, flax, and hemp fibers were added to nylon 6 using melt mixing to produce compounded pellets. The natural fibers/ nylon6 composites with varying concentrations…

Polymer crystallization and propertiesPolymer Nanocomposites and PropertiesNatural Fiber Reinforced Composites

Basics of magnetic nanoparticles for their application in the field of magnetic fluid hyperthermia

Vicky Mody、Ajay Singh、Bevins Wesley2013-03-13European Journal of Nanomedicine

Abstract The use of non-invasive alternating magnetic field (AMF) on biocompatible, small sized iron oxide nanoparticles can be used for heat generation in magnetic hyperthermia or for contrast enhancement of biological tissue. However, the behavior of magnetic nanoparticle in the presence of magnetic field is restric…

Nanoparticle-Based Drug DeliveryIron Metabolism and DisordersCharacterization and Applications of Magnetic Nanoparticles

Low-Temperature Approach to Highly Emissive Copper Indium Sulfide Colloidal Nanocrystals and Their Bioimaging Applications

Kui Yu、Peter Ng、Jianying Ouyang 等 14 位作者2013-03-13ACS Applied Materials & Interfaces

We report our newly developed low-temperature synthesis of colloidal photoluminescent (PL) CuInS2 nanocrystals (NCs) and their in vitro and in vivo imaging applications. With diphenylphosphine sulphide (SDPP) as a S precursor made from elemental S and diphenylphosphine, this is a noninjection based approach in 1-dodec…

Quantum Dots Synthesis And PropertiesChalcogenide Semiconductor Thin FilmsNanocluster Synthesis and Applications

Bulk-solvent and overall scaling revisited: faster calculations, improved results

Pavel V. Afonine、Ralf W. Grosse‐Kunstleve、Paul D. Adams 等 4 位作者2013-03-13Acta Crystallographica Section D Biological Crystallography

A fast and robust method for determining the parameters for a flat (mask-based) bulk-solvent model and overall scaling in macromolecular crystallographic structure refinement and other related calculations is described. This method uses analytical expressions for the determination of optimal values for various scale f…

Protein Structure and DynamicsComputational Drug Discovery MethodsEnzyme Structure and Function