Dynamic simulations of the molecular conformations of wild type and mutant xanthan polymers suggest that conformational differences may contribute to observed differences in viscosity

Xanthan gum is an exopolysaccharide secreted by the bacterium Xanthamonas campestris whose ability to make solutions viscous at low concentrations and over a pH and temperature range have generated much interest in both academic and industrial environments. Mutant Xanthamonas strains have been derived that produce xanthan gums with an altered or variant subunit chemical structure and different measured viscosities when compared with the wild type (wt) form of the polymer. Two variant gums were targeted as potentially interesting in this study, these being the nonacetylated tetramer (natet) and the acetylated tetramer (atet), which both lack a side-chain terminal mannose residue and in one case (natet) lacks an acetate group on an internal mannose residue. Solutions of these tetrameric gums possess viscosities higher (natet) and lower (atet) than the wt gum, and therefore we have attempted to determine whether these molecules possess unique conformational preferences when compared with the wt and with each other. In this manner we can initiate an understanding of how a polysaccharide's conformation contributes to its solution properties. The GEGOP software permits a sampling of the static and dynamic equilibrium states of carbohydrate molecules, and this software was employed to calculate equilibrium states of representative oligosaccharides with chemical structures representative of xanthan-like molecules. Energy minimization techniques revealed similar local minima for all three molecules. Some of these minima are comprised of elongate backbone conformations (A type) in which side chains fold onto backbone surfaces. Other minima with A backbones possessed side chains in less intimate backbone contact especially when calculations were performed with a low dielectric constant. This phenomenon was particularly pronounced in the wt molecule where an increased number of negatively charged side-chain residues experience charge repulsion resulting in reduced side-chain-backbone contact. Metropolis Monte Carlo (MMC) dynamic simulations performed with an elevated temperature factor (1000 K) allowed a better qualitative representation of conformational space than 300 K simulations. Employing a nonhierarchical cluster analysis method (population density profile: PDP) coupled with a classification scheme, it was possible to partition resulting MMC data sets into conformational families. This analysis revealed that in simulations performed with different dielectric constant values (10, 25, and infinity) all molecules possessed primarily A-type backbones. Less elongate, more open helical backbone forms (B, C, D, J, and Flat-a) did occur during the simulations but were populated to a lesser extent. In the natet molecule significantly open helical backbones existed (E, F, G, H, and I) that did not occur in the lower viscosity wt and atet molecules. PDP clustering methods and subsequent conformational classification applied to the first residue (mannose) of the side chain permitted a determination of side-chain orientation. Comparison of all three molecules indicated a larger population of side-chain conformational families in less direct backbone contact for the wt molecule than either of the variant molecules (natet/atet) suggesting that the side chains in the wt are more flexible. Thus, a major conformational difference between the high viscosity natet and the lower viscosities of the wt/atet is the increased amount of open helical backbone in the natet. In addition, the significant difference between the higher viscosity wt and the lower viscosity atet is the increase side-chain flexibility in the wt. We hypothesize that conformational differences of this kind could form a partial explanation of the observed differences in viscosity between these xanthan-like polymers.     

Microstructures and mechanical properties of welded Fe-12Cr-20Mn austenitic stainless steel

The effects of welding on the tensile and fatigue properties of fully annealed and cold-worked Fe-12Cr-20Mn austenitic stainless steel were evaluated. Room temperature and 500 °C tensile tests and room temperature cantilever beam fatigue tests were accomplished on specimens that contained autogenous bead-on-plate welds. The tensile and fatigue properties of the fully annealed material were not significantly influenced by welding. The tensile properties of the welded cold-worked material were also not significantly affected by the presence of a weldment. However, welding caused a large reduction of the fatigue life of the cold-worked material. Fatigue cracks preferentially initiated at large Mn-Si inclusions that formed in the fusion zones of the weldments.     

Fluxoid pinning by vanadium carbide precipitates in superconducting vanadium

Vanadium carbide precipitates were formed in pure, annealed vanadium foils by the introduction of carbon in the specimens. Thin, disk-shaped precipitates resulted with mean diameters in the range 100–2600 Å and with number densities from 3 × 10¹⁵ to 4 × 10¹⁷ particles/cm³. The macroscopic, pinning-force density for magnetic fluxoids was measured at temperatures from 2 to 5 K and for magnetic fields from 0 to H _c2(T). Peak pinning-force densities in the range of 3 × 10 to 3 × 10⁶ dyn/cm³ for T=0K were realized in the 30 specimens studied. The pinning force density was found to obey a scaling law for specimens meeting certain requirements with respect to precipitate particle size and number density. These requirements correlate with the temperature-dependent, superconducting coherence length (T). Many specimens obeyed the scaling law at temperatures T < T _c except near T _c, where (T) is large in comparison with the precipitate size.Part of this work was supported by the Applied Research Laboratory of The Pennsylvania State University, under contract with the U.S. Naval Sea Systems Command.     

Room temperature oxidation of lead-indium alloy films

The kinetics of growth of thin (14 to 40Å) oxide layers on lead-indium alloys was investigated ellipsometrically, using: 3000Å thick films at 23°C; and oxygen exposures at 760 torr for times ranging from five minutes to five days. Assuming that the oxide layer is comprised of a two-phase mixture of PbO and In₂O₃ having a negligible extinction coefficient made it possible to estimate the oxide composition from the ellipsometrically-obtained oxide refractive index. Under these oxidizing conditions, the volume fraction of PbO in the oxide mixture decreases from a value of unity for pure lead to zero for alloys containing more than 30 at. percent In, in agreement with the Auger Electron Spectroscopy results of Chou and coworkers. The oxidation rate equals a exp (X₁/X), where α and X₁ will be seen to vary complexly with alloy composition. A theoretical explanation of these results is also presented.     

Tailored microstructure of zirconia and hafnia-based thermal barrier coatings with low thermal conductivity and high hemispherical reflectance by EB-PVD

Zirconia and hafnia based thermal barrier coating materials were produced by industrial prototype electron beam-physical vapor deposition (EB-PVD). Columnar microstructure of the thermal barrier coatings were modified with controlled microporosity and diffuse sub-interfaces resulting in lower thermal conductivity (20–30% depending up on microporosity volume fraction), higher thermal reflectance (15–20%) and more strain tolerance as compared with standard thermal barrier coatings (TBC). The novel processed coating systems were examined by various techniques including scanning electron microscopy (SEM), X-ray diffraction, thermal conductivity by laser technique, and hemispherical reflectance.     

The Innate Immune Glycoprotein Lactoferrin Represses the Helicobacter pylori cag Type IV Secretion System

Chronic infection with Helicobacter pylori increases risk of gastric diseases including gastric cancer. Despite development of a robust immune response, H. pylori persists in the gastric niche. Progression of gastric inflammation to serious disease outcomes is associated with infection with H. pylori strains which encode the cag Type IV Secretion System (cag T4SS). The cag T4SS is responsible for translocating the oncogenic protein CagA into host cells and inducing pro-inflammatory and carcinogenic signaling cascades. Our previous work demonstrated that nutrient iron modulates the activity of the T4SS and biogenesis of T4SS pili. In response to H. pylori infection, the host produces a variety of antimicrobial molecules, including the iron-binding glycoprotein, lactoferrin. Our work shows that apo-lactoferrin exerts antimicrobial activity against H. pylori under iron-limited conditions, while holo-lactoferrin enhances bacterial growth. Culturing H. pylori in the presence of holo-lactoferrin prior to co-culture with gastric epithelial cells, results in repression of the cag T4SS activity. Concomitantly, a decrease in biogenesis of cag T4SS pili at the host-pathogen interface was observed under these culture conditions by high-resolution electron microscopy analyses. Taken together, these results indicate that acquisition of alternate sources of nutrient iron plays a role in regulating the pro-inflammatory activity of a bacterial secretion system and present novel therapeutic targets for the treatment of H. pylori-related disease.     

冶炼烟气净化：所有步骤在一台设备内完成

介绍Kimre公司的SXF^TM半错流洗涤器的结构、优点和应用。该洗涤器采用卧式并流气液接触方式,可根据需要分隔成不同操作段,在由交织单丝构成的纤维介质上完成气体的冷却、净化和除沫。与传统立式逆流填料塔相比,该洗涤器的优点为：高度低,泵、阀门、控制器等可在地面安装,容易操作和维修;液气比范围宽;可进行多级操作,包括在一台设备内完成多个化学过程。如用于冶炼烟气净化,所有步骤可在一台设备内完成。列举了化肥厂造粒塔气体净化、磷酸厂气体除氟和硫酸厂干燥塔除沫等应用实例。     

A High-Frequency Variable-Voltage-Fed Inverter

A half-bridge inverter circuit capable of providing a wide range of ac output voltages and frequencies is presented. The inverter uses asymmetrical thyristors (ASCR's), which have the advantages of high-power handling capability, small turn-on and turn-off times, and exhibit the same ruggedness associated with conventional thyristors in regards to surge current and gating requirements. By using ASCR's for the main and auxiliary devices, the inverter offers other advantages such as low snubber-power loss, low commutation loss, simple protection circuits, and the ability to operate at high frequencies with different types of loads. Output voltage control is obtained by feeding the inverter from a variable dc source. Two fixed-value auxiliary dc sources are used to obtain a constant-current interruption capability. The performance of the inverter is evaluated both analytically and experimentally.     

High-throughput method for the production and analysis of large natural product libraries for drug discovery

High-throughput methods were applied to the production, analysis, and characterization of libraries of natural products in order to accelerate the drug discovery process for high-throughput screening in the pharmaceutical and biotechnology industries. Library production integrates automated flash chromatography, solid-phase extraction, filtration, and high-throughput parallel four-channel preparative high-performance liquid chromatography to obtain the libraries in 96- or 384-well plates. Libraries consist of purified fractions with approximately one to five compounds per well. Libraries are analyzed prior to biological screening by a high-throughput parallel eight-channel liquid chromatography-evaporative light scattering detection-mass spectrometry system to determine the molecular weight, number, and quantity of compounds in a fraction. After biological screening, active fractions are rapidly purified at the microgram level and individual compounds are rescreened for confirmation of activity. Structures of active compounds are elucidated by NMR spectroscopy and mass spectrometry. Utilization of a novel microcoil probe allows NMR data to be gathered on 50 microg. As a demonstration, a library was made from the stem bark of Taxus brevifolia. Biological screening in the National Cancer Institute's in vitro panel of three cancer cell lines demonstrates that the process enables the discovery of active anticancer compounds not detected in the flash fractions from which the library originates.