Using Toad Oocytes as an Ultrasensitive System for Estimating the Biological Activity of Trichosanthin

A sensitive bioassay for estimating the activity of Trichosanthin was developed by using intraoocyte microinjection as the technique and germinal vescicle breakdown as a marker. The GVBD inhibitory activity assay was million-fold more sensitive than the routinely used abortifacient activity assay. The detectable amount of Trichosanthin ranged from 0.5 to 100 pg. Since the least detectable dose was 0.5 pg, it made the assay suitable to analyse the microquantity of pure Trichosanthin used for studying the structure and function of the drug.     

低对称性硫代烃基四氮杂卟啉的合成、表征及电化学性质研究

合成了硫代烃基四氮杂卟啉2,3,7,8,12,13-六(甲硫基)-17,18-一(二噻英)四氮杂卟啉[H₂Pz(dtn)(mt)₆]及其过渡金属配合物MPz(dtn)(mt)₆,由元素分析、质谱、¹HNMR、UV-Vis和IR光谱对其组成和结构进行了表征,通过循环伏安测试结果讨论了H₂Pz(dtn)(mt)₆的电化学性质,证明H₂Pz(dtn)(mt)₆的还原过程为单电子连续传输过程,属于CE机理.研究了H₂Pz(dtn)(mt)₆对正极材料MnO₂在锂离子电池中的修饰作用.结果表明,H₂Pz(dtn)(mt)₆对改善锂离子电池的初始充放电容量和循环次数都有明显的增加.     

YVO4∶Sm3+红色发光材料的熔盐法合成与光谱性能

采用熔盐法合成了YVO4∶Sm3+红色发光材料. 用X射线粉末衍射对其结构进行表征, 证实样品为具有锆石结构的YVO4相; 测定了样品的激发与发射光谱; 分析了不同的掺杂浓度和烧结温度对样品发光强度的影响. 研究结果表明, 采用熔盐法合成的样品均可以产生Sm3+的特征发射, 但是与其它方法相比, 熔盐法合成样品位于647 nm处Sm3+的4G5/2-6H9/2发射明显得到加强, 从而使得样品发出明亮的红光, 而不是其它合成方法获得的橙色光. 当掺杂浓度为1%(摩尔分数)且在500 ℃下烧结5 h后, 熔盐法得到的YVO4∶Sm3+荧光粉的发光强度最大.     

Connectivity correlations in three topological spaces of urban bus-transport networks in China

In this paper, an empirical investigation is presented, which focuses on unveiling the universality of connectivity correlations in three spaces （the route space, the stop geographical space and bus-transferring space） of urban bustransport networks （BTNs） in four major cities of China. The underlying features of the connectivity correlations are shown in two statistical ways. One is the correlation between the （weighted） average degree of all the nearest neighbouring vertices with degree k, （Knn^w,（k）） Knn（k）, and k, and the other is the correlations between the assortativity coefficient r and, respectively, the network size N, the network diameter D, the averaged clustering coefficient C, and the averaged distance （l）. The obtained results show qualitatively the same connectivity correlations of all the considered cities under all the three spaces.     

Sm_2Co_（17） magnet blocks for the in-vacuum undulators （IVU20） at the SSRF

The design and development status of Sm₂Co₁₇ magnet blocks for two in-vacuum undulators (IVU20) at the SSRF with the same hybrid design has been described. By the technological improvement of some processes and comparison with the experimental Sm₂Co₁₇ magnet blocks for the IVU25A, magnetic properties such as the intrinsic coercive force H_ci and the average magnetic moment M are increased, the bend point magnetic field H_k value and pass rate are significantly increased, and the magnetic field uniformity of the magnet blocks are significantly improved. The basic developmental method of high uniformity Sm₂Co₁₇ magnet blocks for IVU20 is presented. The magnetic field qualities of the magnet blocks, including the magnetic property, the magnetic moment distribution, the magnetization deviation angle and the magnetic field uniformity, basically satisfy the specifications of the two IVU20 in-vacuum undulators.     

永磁体外部磁场的不均匀性研究

从永磁体的分子电流观点、退磁场、工艺等出发, 以矩形永磁体为例, 从理论上分析了影响永磁体外部磁场不均匀性的各种因素.研究结果表明, 永磁体外部磁场宏观不均匀性(好场区均匀度和面积相对大小) 和空间距离及永磁体的外形设计密切相关. 退磁场对永磁体外部磁场微观不均匀性有着复杂影响. 永磁体工艺如粉末颗粒、取向度、烧结凝固、机械加工等将影响永磁体外部磁场的不均匀性, 如磁化偏角、对称性、光滑性等. 关键词： 永磁体 外部磁场 不均匀性 退磁场     

基于结构的新型CDK7抑制剂的设计、合成及其抗肿瘤活性

根据细胞周期依赖性激酶7(CDK7)的蛋白结构, 利用Discovery Studio 2.1程序包中的LigandFit模块建立了CDK7抑制剂的分子对接模型, 采用受试者工作特征曲线(ROC)方法选择LigScore2为最佳打分函数(ROC曲线下的面积为0.95), 并验证了该模型的准确性. 利用该模型对设计的化合物与CDK7蛋白进行对接分析, 得到了2个打分最高的化合物16、17, 进而通过13步的合成路线, 以中等至高的收率得到目标化合物, 并测定其体外抗肿瘤活性. 结果表明, 所合成的化合物对急性前髓细胞性白血病细胞(HL60)、鼻咽癌细胞(KB)、肝肿瘤细胞(SMMC-7721)、结肠腺癌细胞(HCT-116)、肺癌细胞(A549)细胞株均有抑制作用(IC50值为0.84-19.70 μmol·L-1), 其中化合物16对HL60细胞株的IC50值最低, 为0.84 μmol·L-1.     

Vibrational Spectroscopic Study of （E）-3-（4-fluorophenyl）-N-[4-（phenylamino） quinazoline-7-yl] Acrylamide

Geometry optimization and subsequent harmonic vibration calculations of prior synthesized (E)-3-(4-fluorophenyl)-N-[4-(phenyl-amino) quinazoline-7-yl] acrylamide were carried out by DFT/B3LYP method with both 6-31G and 6-311G basis sets.The Infrared (IR) spectrum of the title compound was recorded in the field of 400-4000 cm 1 and then assigned.The correlation analyses between the scaled theoretical vibration frequencies and the experimental ones indicate that there exist good linearity relationships since the correlation coefficients R 2 are larger than 0.999.The intramolecular interactions existed in the title molecule were confirmed by the Atoms in molecules (AIM) method,and their influences on the absorption frequency were also investigated.     

Structural polarization properties of vector Gaussian beam in the far field

Based on the vector angular spectrum representation of optical beam and the method of stationary phase, the analytical TE and TM terms of vector Gaussian beam have been presented in the far field. By using the local polarization matrix, the polarization properties of the TE and TM terms in the far field are investigated, and it is found that the degree of their polarization is only determined by the spatial location. When the source is completely polarized, the TE and TM terms are both completely polarized in the far field. When the source is completely unpolarized, the TE and TM terms in the far field are partially polarized. The whole beam is also partially polarized except on the propagating axis. Moreover, the degrees of polarization of TE and TM terms are both larger than that of the whole beam.[第一段]     

p53-MDM2结合抑制剂药效团模型的构建

采用Catalyst软件, 选择5类共24个p53-MDM2结合抑制剂作为训练集, 经计算机建模、构象优化, 由Catalyst系统构建出药效团模型, 并对药效团进行有效性分析, 结合已知的p53-MDM2结合抑制剂的结构信息, 筛选得到含有一个芳环中心、三个疏水中心和一个氢键受体的具有较好预测能力(Correl=0.941, Config=17.530, 吟cost=150.830)的药效团模型.