Comparative molecular field analysis of chromatographic hydrophobicity indices for some coumarin analogs

The chromatographic hydrophobicity index (CHI) is an HPLC‐based parameter that provides reliable guidance in optimization of pharmacological efficiency and adsorption, distribution, metabolism and exertion (ADME) profile of drug candidates. In the present work, classical and three‐dimensional quantitative structure–property relationship (QSPR) models were developed for prediction of CHI values of some 4‐hydroxycoumarin analogs on immobilized artificial membrane column. Comparative molecular field analysis (CoMFA) and comparative molecular similarity indices analysis (CoMSIA) as 3D–QSPR methods were performed to gain insight into the key structural factors affecting on the chromatographic hydrophobicity of interested chemicals. The calculated parameters of Q ², R ² and standard error were 0.545, 0.996 and 0.773 for CoMFA model and 0.815, 0.986 and 1.44 for CoMSIA model, respectively. The contour maps for steric fields of the CoMFA model illustrate that the hydrophobicity of chemicals will be higher when the positions of R6, R7 and R8 in the 4‐hydroxycuomarin ring are substituted by alkyl groups. Moreover, by the analysis of the plots of electrostatic fields, it was concluded that the CHI value greatly increases if one hydrogen on coumarin ring is substituted by the F, Cl, Br, OH or OCH₃ group.     

Naturally derived green bio-additives

During the last few years, special attention has been paid by the lubricant industry towards vegetable oil-based lubricants due to their biodegradability, renewability and excellent tribological properties. But to maintain the biodegradability of the final lubricants, the additive in the lubricants must also be biodegradable. Hence, in our present work, multifunctional lubricating oil additive based on castor oil has been investigated as a less toxic, feasible alternative to traditional petroleum based additives. Homopolymer of castor oil and its copolymer with α-pinene were synthesized by a thermal method using azobisisobutyronitrile as a radical initiator. Characterization of the prepared polymers was performed by spectral analysis and gel permeation chromatography (GPC). Additive performances of each of the prepared polymers as viscosity index improvers/viscosity modifiers and pour point depressants were carefully evaluated. Photo micrographic image was used to study the effectiveness of the additives as pour point depressants. Thermogravimetric analysis (TGA) was conducted to investigate the thermal response of the additives at high temperature. Finally, biodegradability of all the polymers was tested against fungal pathogen by the disc diffusion method and soil burial test. The study illuminated excellent additive performances of the polymers and thus their potential for acting as entirely naturally derived green bio-additives for lube oil.     

Synthesis and nanoimprinting of high refractive index and highly transparent polythioethers based on thiol-ene click chemistry

This work demonstrates the UV nanoimprinting lithography (UV-NIL) of high refractive index and highly transparent polythioethers based on thiol-ene click chemistry. Herein, 9,9-bis(3-mercaptopropylphenylether)fluorene (BMPF) is designed as a new thiol monomer with a high refractive index, high transparency, and good processability for UV-NIL. Colorless polythioethers are synthesized from BMPF and ene monomers under mild thiol-ene click reaction conditions. Excellent transmittance (96%) of 400 nm light is observed in all the polymer films and high refractive index values of 1.5972–1.6382 are attained. UV-NIL using thiol-ene photopolymerization affords polymer nanoimprinting patterns with various features on the order of 100–500 nm without any fractures. To the best of our knowledge, this is the first report on UV-NIL of high refractive index and highly transparent polymers. Through proper monomer and polymer design, novel polythioethers with suitable glass transition temperature (T _g) values are developed with high refractive index, high transparency, and good UV-NIL processability. Furthermore, UV-NIL based on thiol-ene click chemistry is accomplished at the nanoscale. © 2018 Wiley Periodicals, Inc. J. Polym. Sci., Part A: Polym. Chem. 2018 , 56, 2175–2182     

Temperature dependence of the properties of ternary systems ethanol + water + an aliphatic alkane (C6-C9)

The measures and calculation of different properties such as refractive index, density, speed of sound, excess molar volume, and isentropic compressibility of the ternary heterogeneous compounds by ethanol + water + (n-hexane, n-heptane, n-octane, n-nonane) have been performed in the range 288.15–323.15 K and atmospheric pressure. Attending to the accurate results of these models, the equation of state enclosing mixing rules is indicated as a simple estimation of the procedures of these properties for this kind of multicomponent systems.     

The Acceleration Severity Index in the impact of a vehicle against permanent road equipment support structures

The acceleration Severity Index (ASI), described in European Standard EN12767 (The passive safety of support structures for road equipment. Requirements, classification and the test method) is regarded as the most important indicator of impact on the occupants. The requirements for experiments are described, having in mind that the results depend on many factors. One of them is the selection of a vehicle to be used in the crash test. To perform numerical vehicle crash simulation, the finite-element models of permanent road equipment support structures were developed using the LS Dyna software available. To examine the response of the vehicle upon the impact, the acceleration severity index curves were calculated and visualised in Matlab.     

Exact solution of functionally graded thick cylinder with finite length under longitudinally non-uniform pressure

Elastic analysis of a functionally graded thick-walled cylindrical pressure vessel is analytically studied in the present research. Gradation is considered for all mechanical properties along the thickness direction based on a power function. The constitutive relations are developed in the general cylindrical coordinate system for an axisymmetric pressurized cylinder. For simulation of these two deformation components, first order shear deformation theory is considered. The FG cylinder is subjected to longitudinally non-uniform pressure along the length of the cylinder. The present problem is applicable for simulation of non-uniform pressurized cylinder by fluids or gases.     

Nontrivial Solutions for p-Laplace Equations with Right-Hand Side Having p-Linear Growth at Infinity

ABSTRACT

The existence of a nontrivial solution for quasi-linear elliptic equations involving the p-Laplace operator and a nonlinearity with p-linear growth at infinity is proved. Techniques of Morse theory are employed.     

基于解释结构模型的大学生就业影响因素分析

针对大学生就业率低的问题,构建大学生就业评价指标体系,利用解释结构模型的实用化方法对大学生就业影响因素进行了分析,并构建大学生就业影响因素的解释结构模型.根据解释结构模型层次化处理结果,分析各个因素之间的联系,将大学生就业影响因素分为四个层次,明确大学生就业影响因素的层次结构关系,找出导致大学生就业率低的最直接因素和最根本因素.     

Coherent communications

Abstract

Coherent lightwave techniques, when compared to direct detection techniques, offer nearly quantum noise limited sensitivity as well as fine tunability similar to that obtained at radio frequencies. These two aspects provide communication systems planners and engineers the means to better exploit the huge bandwidth of single mode optical fibers.

Research activity in this field started in the early 1980s, and some laboratory experiments and field trials were performed by the end of the decade, showing that such techniques are suitable for transmitting multigigabit per second signals to distances well exceeding hundred kilometers. On the other hand, coherent multichannel, frequency division multiple access, local area networks have been proposed and experimented worldwide.

This article will discuss the theoretical advantages and limitations of the various modulation and detection formats together with the state of the art. Moreover, some aspects, related to the introduction of coherent systems in local and metropolitan area networks, will be treated. Finally some experimental data will be provided and future evolution will be discussed.