1,3,4—恶二唑的酰基硫脲衍生物的合成

从邻氯苯酚出发合成邻氯苯氧乙酰异硫氯氰酸酯，分别与５种２－氨基－５－芳基－１，３，４－恶二反应得到１，３，４－恶二唑的邻氯苯氧乙酰基硫脲衍生物，用ＩＲ，＾１ＨＮＭＲ，元素分析等对它们的结构进行了确证，并分析归纳合成该目标产物的最佳合成条件。     

Low dipole moment large β electrooptic chromophores based on exocyclic double bond conjugated bridge

Novel low dipole moment (μ) and large first hyperpolarizability (β) electrooptic chromophores have been designed based on the special characteristic of reversed dipole moment in the excited state of exocyclic double bond (ECDB) conjugated bridge by the optimization of the substituted method, and their electronic and second-order nonlinear optical properties have been theoretically investigated by employing the AM1/FF and ZINDO/S-CI approaches. By extending the conjugation length and optimizing the donor/acceptor strength, the oscillator strength of the excited transition that contributes to the molecular nonlinearity can be further enhanced. The designed chromophores possess a larger figure of merit (FOM) than that of 4-N,N-dimethylamino-4′-nitrostilbene (DANS), and lower (<5 D) ground state dipole moment.     

Conformational analysis on anti-HIV-1 peptide T22([Tyr5,12,Lys7]-polyphemusinⅡ )

The conformational scan of anti-HIV peptide T22 ([Tyrsup>5,12, Lys⁷]-polyphemusinⅡ) backbone on a deformed potential energy surface (PES) was performed using the potential smoothing searching (PSS) protocol. All located minima were then transferred to the original PES using undeformed optimized potentials for liquid simulations (OPLS) potential function, and minimized by multi-conformer minimization (MCM). For solution-phase calculations, the GB/SA continuum model for water was used. This application of PSS integrated with MCM is proved a feasible method for solving the multiple-minimum problem in the conformational analysis of flexible molecules with cyclic structure.     

黑河市厂矿企业生产性噪声调查分析

本文调查了黑河市各县（市）区９个行业，３２家厂矿企业的生产性噪声。通过这次调查，掌握了我市生产性能噪声的强度分布，行业分布，声源分布规模模，为治理生产性噪声提供了科学依据。     

K1,r-free图中点独立数与其它参数之间的关系

给出了K1，r-free图中点独立数与其它参数如点数，边数，坚韧度，连通度等之间的一些关系。     

三类正则矩阵的特征值幂和

本文用图论方法和矩阵分块技巧，讨论了正则（0，1）矩阵的特征值幂和问题，改进了现有文献的一些结果。     

老年冠心病心理护理体会

本文介绍了对老年冠心病人的心理护理体会及具体方法。     

山岭区高速公路线形设计初探

本文对山岭区高速公路设计中与平原区设计不同之处从几个方面做了探讨和说明。     

求解一类有心场的定态问题

利用SU( 1 ,1 )谱生成代数方法 ,求解出三维谐振子、氢原子和二维氢原子的定态能谱 ,并由Bohr的Hamiltonian导出描述原子核转动谱公式 :吴 -曾公式     

δ铁素体对12%Cr超超临界转子钢冲击性能的影响

高中压转子是超超临界火电机组的关键零部件,要求具有很高的高低温冲击性能,材料一般采用高铬(12%Cr)耐热合金钢.该文通过一系列实验,研究了12%Cr转子钢1Cr12W2NiMoVNbN钢组织中δ铁素体对室温冲击性能的影响.结果表明:δ铁素体的存在会严重损害该钢的冲击性能,而奥氏体晶粒尺寸在一定范围内对其冲击性能影响不大;对已经出现的δ铁素体,可以用在900～1 150℃温度区间长期保温的方法进行消除.研究结果对科学制定超超临界高中压转子铜热处理工艺具有参考价值.