Polydopamine-Assisted Rapid One-Step Immobilization of L-Arginine in Capillary as Immobilized Chiral Ligands for Enantioseparation of Dansyl Amino Acids by Chiral Ligand Exchange Capillary Electrochromatography

Herein, a novel L-arginine (L-Arg)-modified polydopamine (PDA)-coated capillary (PDA/L-Arg@capillary) was firstly fabricated via the basic amino-acid-induced PDA co-deposition strategy and employed to constitute a new chiral ligand exchange capillary electrochromatography (CLE-CEC) method for the high-performance enantioseparation of D,L-amino acids (D,L-AAs) with L-Arg as the immobilized chiral ligand coordinating with the central metal ion Zn(II) as running buffer. Assisted by hydrothermal treatment, the robust immobilization of L-Arg on the capillary inner wall could be facilely achieved within 1 h, prominently improving the synthesis efficiency and simplifying the preparation procedure. The successful preparation of PDA/L-Arg coatings in the capillary was systematically characterized and confirmed using several methods. In comparison with bare and PDA-functionalized capillaries, the enantioseparation capability of the presented CLE-CEC system was significantly enhanced. Eight D,L-AAs were completely separated and three pairs were partially separated under the optimal conditions. The prepared PDA/L-Arg@capillary showed good repeatability and stability. The potential mechanism of the greatly enhanced enantioseparation performance obtained by PDA/L-Arg@capillary was also explored. Moreover, the proposed method was further utilized for studying the enzyme kinetics of L-glutamic dehydrogenase, exhibiting its promising prospects in enzyme assays and other related applications.     

Ruthenium (II) Catalyzed C(sp2)−H Bond Alkenylation of 2-Arylbenzo[d]oxazole and 2-Arylbenzo[d]thiazole with Unactivated Olefins

Functionalization of the bio-relevant heterocycles 2-arylbenzo[d]oxazole and 2-arylbenzo[d]thiazole has been achieved through Ru(II)-catalyzed alkenylation with unactivated olefins leading to selective formation of the mono-alkenylated products. This approach has a broad substrate scope with respect to the coupling partners, affords high yields, and works for gram scale synthesis using a readily available Ru-based catalyst. Mechanistic studies reveal a C−H activation pathway for the dehydrogenative coupling leading to the alkenylation. However, the results of the ESI-MS-guided deuterium kinetic isotope effect studies indicate that the C−H activation stage may not be the rate-determining step of the reaction. The use of a radical scavenging agent such as TEMPO did not show any detrimental effect on the reaction outcome, eliminating the possibility of the involvement of a free-radical pathway.     

Triazine interlinked covalent organic polymer as an efficient anti-bacterial agent

Herein, we report the synthesis of new covalent organic polymer comprising triazine and o-tolidine by solvothermal method. The formation of polymer was confirmed by Fourier transform infra red spectroscopy (FT-IR), cross polarization–magic angle spinning nuclear magnetic resonance (NMR), transmission electron microscopy, and scanning electron microscopy. Their antibacterial activity toward S. aureus (gram-positive) and P. aeruginosa (gram-negative) was assessed by the optical density measurements and direct contact method. These results have great significance toward the design of new porous polymers for antibacterial applications.     

Molecular structural investigations of quinoxaline derivatives through 3D-QSAR,molecular docking,ADME prediction and pharmacophore modeling studies for the search of novel antimalarial agent

In the present article, a dataset of 63 quinoxaline derivatives were taken for antimalarial activity and pharmacophore were developed. Atom based method was used to develop a three dimensional quantitative structure activity relationship (3D-QSAR) model. On comparison of all statistical parameters, model AHRRR23 was found to be the most effective and predictive QSAR model as it satisfied all statistical parameters of a good model. The model AHRRR23 showed an adequate R² value for the training set 0.9446, good predictive power with Q² of 0.6409, good F- value, low SD 0.1218 value and outstanding Pearson-R values and low RMSE 0.2779 values of the model. The docking studies also gives very good results with good RMSD values. 3D QSAR, docking and ADME studies exhibits that the developed model could be employed as a potential lead for further study as antimalarial drug.     

A study of internal heat transfer in nonuniform porous structures

The results of theoretical and experimental studies of heat transfer and pressure drop in nonuniform porous materials and systems are presented. In experiments, measurements were made of the air flow rate, inlet and outlet air pressures, and air and porous sample temperatures. Experimental determination of the heat transfer coefficient in porous structures is associated with certain difficulties. The problem of determining a temperature difference between coolant and porous skeleton is the most complex. As a rule, under laboratory conditions this difference is small and cannot be found with sufficient accuracy. In the present work, the method of determination of the internal heat transfer coefficient is based on solving the inverse unsteady heat transfer problem for porous structures. Using this approach, the heat transfer coefficient is calculated indirectly or on the basis of the porous material temperature variation over time.     

断层破碎带中的透镜体及透镜体力学效应初步研究

断层破碎带中的透镜体及透镜体力学效应研究在文献中不多见。但是许多断层尤其是扭性断层中的透镜体非常发育,这些透镜体往往控制断层破碎带的强度大小和变形破坏机理,是工程岩体中必须重视的工程地质力学问题。作者经研究认为:(1)透镜体类型多种;(2)透镜体周边一般具断层泥线或泥膜分布;(3)透镜体内具有节理裂隙系统;(4)透镜体周边可以当作结构面或软弱结构面看待;(5)透镜体本身可以作为一个复合结构体看待。在原位力学试验中也揭示了断层泥透镜体在原位剪切试验和单轴压缩试验中的若干力学行为,其表现是:(1)透镜体周边具有结构面力学效应;(2)断层泥透镜体控制着强度大小、变形破坏机理。     

An experimental study of the effect of the blow-in rate on the size of the flow separation region

Experimental results are presented concerning the effect of the air blow-in rate on the size of the flow separation region downstream of a rearward-facing step at different step heights. The stream function is found from the experimental velocity profiles, the streamline = 0 being taken as the boundary line. It is shown that the separation region increases as the blow-in rate is increased. Generalization of the experimental results for different blow-in rates and step heights has made it possible to obtain an analytical expression describing the location of some characteristic lines in the separation region (boundary streamline, reverse-flow boundary, line of reverse-flow maximum velocity, line of variable-velocity layer thickness, and the displacement thickness line). Velocity profiles are obtained by means of a hot-wire anemometer. Analytical expressions are written as polynomials with unknown coefficients. The results obtained may be helpful in developing techniques for the treatment of heat transfer under flow separation conditions.     

遥感技术用于固体力学实验研究的新成果

在岩石、混凝土和钢材加载直到破坏的过程中用红外和微波遥感技术进行了观测研究．发现这些材料在加载过程中其红外和微波辐射温度、红外辐射波谱及红外热像均随应力的变化而变化．材料破坏前这些变化表现出某些前兆性特征．研究表明遥感技术可作为固体力学研究的一种新手段，并可望在工程上得到应用     

Slow gas motions and the negative drag of a strongly heated spherical particle

In the slow flows of a strongly and nonuniformly heated gas, in the continuum regime (Kn → 0) thermal stresses may be present. The theory of slow nonisothermal continuum gas flows with account for thermal stresses was developed in 1969–1974. The action of the thermal stresses on the gas results in certain paradoxical effects, including the reversal of the direction of the force exerted on a spherical particle in Stokes flow. The propulsion force effect is manifested at large but finite temperature differences between the particle and the gas. This study is devoted to the thermal-stress effect on the drag of a strongly heated spherical particle traveling slowly in a gas for small Knudsen numbers (M ～ Kn → 0), small but finite Reynolds numbers (Re ≤ 1), a linear temperature dependence of the transport coefficients µ ∝ T, and large but finite temperature differences ((T _w ? T _∞ )/T _M8 ～ 1). Two different systems of equations are solved numerically: the simplified Navier-Stokes equations and the modified Navier-Stokes equations with account for the thermal stresses.     

多孔介质平板通道强迫对流中热局部非平衡时的热应力

根据微观不可压饱和多孔介质热-力-流相互作用的一般理论,在固相骨架小变形的假定下,考虑固相和流相相互作用的粘性耗散,研究了多孔介质平板通道强迫对流热局部非平衡的热应力问题.建立了问题的热-力数学模型,根据饱和多孔介质的平衡方程,在固相骨架只存在横向位移的假定下,求解了固相骨架的位移和相应的热应力,数值考察了各种物性参数对热应力分布的影响,讨论了热局部平衡模型的适用性.