One‐pot green synthesis of Cu/bone nanocomposite and its catalytic activity in the synthesis of 1‐substituted 1H‐1,2,3,4‐tetrazoles and reduction of hazardous pollutants

In this work, a simple and green method is reported for the biosynthesis of Cu/bone nanocomposite using Cordyline fruticosa extract as a stabilizer and reductant. Animal bone was used as a natural support to prevent the accumulation of Cu nanoparticles. The catalytic activity of Cu/bone nanocomposite was assessed in the synthesis of 1‐substituted 1H‐1,2,3,4‐tetrazoles and reduction of various organic dyes, including 4‐nitrophenol (4‐NP), nigrosin (NS), congo red (CR) and methylene blue (MB). The best catalytic performance in the synthesis of 1‐substituted tetrazoles was achieved using 0.05 g of Cu/bone nanocomposite at 120°C. In addition, under optimal conditions, the absorption bands corresponding to 4‐NP, CR, NS and MB completely disappeared after about 6 min, 3 min, 50 s and 7 s, respectively. The biosynthesis protocol used in the preparation of Cu/bone nanocomposite offers a very attractive area for further research.     

端部激励相位差下斜拉索的非线性振动

斜拉桥中拉索承受着多种端部激励，可激发大幅空间振动．以斜拉索为对象，探究不同端部激励间相位差对其非线性振动的影响．首先，推导斜拉索无量纲离散控制方程，引入考虑相位的三向端部激励得到一般化模型；然后，针对拉索下端存在的纵桥向、竖向和横桥向激励的两两组合，受大幅或小幅激励，及其在主共振区或主参数共振区几组因素，共计12种工况，采用数值分析法分别研究了各工况下不同激励相位差时的斜拉索稳态响应．研究发现：激励相位差能加剧与激励频率相近的面内、外模态振动；在任意端部激励组合下，激励相位差不仅可使斜拉索非线性振动出现定量变化，还可改变内共振的表现形式．面内、外激励组合下，相位差对拉索响应幅值的影响以π为周期变化，且当相位差趋于π/2 + kπ (k = 0, 1, 2…)时影响最为突出；而面内激励组合下，以2π为变化周期，当相位差为π + 2kπ (k = 0, 1, 2, …)时其对稳态幅值的影响最显著．其原因是：面外激励关于拉索所在的竖直面对称，故其本质上以π为周期；而面内激励无此对称性，仍以2π为周期．因此，有无面外激励参与决定了激励间相位差对斜拉索响应的影响规律．     

Computation of Spatial Covariance Matrices

In an earlier article, Ghosh derived the density for the distance between two points uniformly and independently distributed in a rectangle. This article extends that work to include the case where the two points lie in two different rectangles in a lattice. This density allows one to find the expected value of certain functions of this distance between rectangles analytically or by one-dimensional numerical integration.

In the case of isotropic spatial models or spatial models with geometric anisotropy terms for agricultural experiments one can use these theoretical results to compute the covariance between the yields in different rectangular plots. As the numerical integration is one-dimensional these results are computed quickly and accurately. The types of covariance functions used come from the Matérn and power families of processes. Analytic results are derived for the de Wijs process, a member of both families and for the power models also.

Software in R is available. Examples of the code are given for fitting spatial models to the Fairfield Smith data. Other methods for the estimation of the covariance matrices are discussed and their pros and cons are outlined.     

Fly‐Ash‐Supported Synthesis of 2‐Mercaptobenzothiazole Derivatives under Microwave Irradiation

Microwave‐assisted, solvent‐free alkylation and acylation of 2‐mercaptobenzothiazole has been attempted using silica gel, alumina, and a new solid support, fly ash. Fly ash, a waste generated at thermal power stations, could be used as solid support just as efficiently as commercial supports. The additional features of methodology include a much faster reaction, easy workup, higher yields, higher purity of the products, and an ecofriendly approach.     

Optimal control of self-organized dynamics in cellular signal transduction

We demonstrate how model-based optimal control can be exploited in biological and biochemical modelling applications in several ways. In the first part, we apply optimal control to a detailed kinetic model of a glycolysis oscillator, which plays a central role in immune cells, in order to analyse potential regulatory mechanisms in the dynamics of associated signalling pathways. We demonstrate that the formulation of inverse problems with the aim to determine specific time-dependent input stimuli can provide important insight into dynamic regulations of self-organized cellular signal transduction. In the second part, we present an optimal control study aimed at target-oriented manipulation of a biological rhythm, an internal clock mechanism related to the circadian oscillator. This oscillator is responsible for the approximate endogenous 24 h (latin: circa dies) day-night rhythm in many organisms. On the basis of a kinetic model for the fruit fly Drosophila, we compute switching light stimuli via mixed-integer optimal control that annihilate the oscillations for a fixed time interval. Insight gained from such model-based specific manipulation may be promising in biomedical applications.     

Fast analysis of triterpenoids in Ganoderma lucidum spores by ultra‐performance liquid chromatography coupled with triple quadrupole mass spectrometry

A rapid and reliable method was established for simultaneous determination of main triterpenoids in Ganoderma lucidum spores using ultra‐high‐performance liquid chromatography coupled with triple quadrupole mass spectrometry (UPLC‐TQ‐MS). The established method was validated in terms of linearity, sensitivity, precision, accuracy and stability, and was successfully applied to determine the contents of 10 main triterpenoids in different batches of G. lucidum spores. The analysis results showed that moderate levels of triterpenoids were found in G. lucidum spores. In addition, a MS full scan with a daughter ion scan experiment was performed to identify the potential derivatives of triterpenoids present in G. lucidum spores. As a result, a total of 22 triterpenoids from different G. lucidum spores were unequivocally or tentatively identified via comparisons with authentic standards and literatures. This method provides both qualitative and quantitative results without the need for repetitive UPLC‐MS analyses, thereby increasing efficiency and productivity, making it suitable for high‐throughput applications. Copyright © 2013 John Wiley & Sons, Ltd.     

Improved excitation uniformity in multiple‐quantum NMR experiments of mixtures

Multiple‐quantum ¹H NMR spectroscopy has been finding a renewed interest for its possible applications in the analysis of mixtures of small molecules, due to its simplification properties. A crucial aspect of this application of multiple‐quantum NMR is the sensitivity of the spectrum intensity to the molecular structure and to the parameterization of the experiment, which could result in the missing of some components. We demonstrate that a general scheme to overcome this drawback consists in varying the experiment parameterizations over a small number of values, selected according the values of the couplings and the relaxation rates. Copyright © 2013 John Wiley & Sons, Ltd.     

基于支持向量机的凝血功能诊断模型

使用凝血四项指标诊断凝血功能是临床的常规检查,但根据经验进行诊断正确率不高.剔除临床上最重要的指标FIB后,建立支持向量机模型诊断的正确率和根据凝血四项指标诊断的正确率没有显著差异,100次模拟的平均正确率分别达到了95.4496%和95.5039%.