酶促聚合与ATRP结合合成聚己内酯和聚N,N-二甲氨基甲基丙烯酸乙酯嵌段共聚物及其自组装

摘要：用化学酶法合成聚己内酯（PCL）和聚N,N-二甲氨基甲基丙烯酸乙酯（PDMAEMA）双亲嵌段聚合物（PCL-b-PDMAEMA）。通过核磁共振（1H NMR）,红外光谱仪(FTIR-IR),凝胶渗透色谱(GPC) 对其结构以及分子量与其分子量分布情况进行了表征。对聚合物的溶液性质进行了研究,结果表明：临界胶束浓度（CMC）嵌段聚合物中疏水链段增多有利于形成胶束,表现为CMC降低,并具有较高的热力学稳定性。PDMAEMA是PH和温度敏感材料,研究发现,在不同的温度和pH值条件下表现不同的聚集状态, 当聚合物的pH值降低时平均流体力学直径增加,温度升高平均流体力学直径降低。     

A note on maximizing the permanent of a positive definite hermitian matrix,given the eigenvalues ∗

As a step toward understanding the unsolved problem of determining how large the permanent of a positive semi-definite matrix can be, given the eigenvalues, we note that a necessary condition for A to be a permanent maximizing matrix is that A commute with its permanental adjoint.     

Theoretical Studies on the First Hyperpolarizabilities of One-dimensional Donor-bridge-acceptor Chromophores and New Applications of BLA in Determining Molecular First Hyperpolarizabilities

We present a quantum-chemical analysis of the relationship between the bond length alteration （BLA） and the static first hyperpolarizability of a series of one-dimensional （1D） chromophores with donor-bridge-acceptor （D-B-A） structures. The calculated results show that the parameter BLA can be considered as an indicator to evaluate the molecular first hyper- polarizability. Along the direction of molecular ground-state dipole moments, the evolutions of BLA can be classified into three categories： the first is a non-monotonic line, which represents most chromophores; the second is monotonic increasing; and the third, contrarily, is monotonic decreasing. On the whole, the first hyperpolarizabilities of these studied chromophores are the monotonic functions of BLA along the direction of dipole moments. Therefore, the first hyperpolarizability of these 1D chromophores can be preliminarily evaluated in terms of the development of BLA without a rigorous computation. In other words, one can roughly estimate the relative magnitude of the first hyperpolarizability according to the optimized geometry.     

Theoretical Studies on the Binding of Cd~（2＋） to Uracil and Its Thio-derivatives

The interaction of Cd2+ with uracil,2-thiouracil,4-thiouracil and 2,4-dithiouracil have been investigated by the density functional theory(DFT) calculations.For uracil and 2,4-dithiouracil,where the two basic sites are the same,Cd2+ attachment to the heteroatom at position 4 is preferred.However,for the systems where both types of basic centers,a carbonyl and a thiocarbonyl groups,are present,Cd2+ association with sulfur is favorable.The enhanced stability of these enolic and thiol forms comes from Cd2+ interaction with two basic sites simultaneously,which thereby triggers a significant aromatization of the ring.More significantly,the Cd2+ binding energy with uracil and its thio-derivatives is larger than the tautomerization barriers connecting the diketo-like forms with the corresponding enolic-like tautomers.Consequently,when associated with Cd2+,all tautomers are energetically accessible and should be observed in the gas phase.     

158A GeV/c Pb+Pb碰撞可能有QGP的一旁证

用不含QGP假设的强子和弦级联模型(JPCIAE) ,研究了CERNWA98实验组新近发表的158 AGeV/c Pb+Pb中心碰撞中直接光子和π⁰粒子的横动量分布:两者的理论结果均一致的低于实验值.联系到JPCIAE能成功解释无直接光子超出确切迹象的WA80和WA93对200A GeV/c S+Au中心碰撞测量得出的结果:因而为158A GeV/c Pb+Pb中心碰撞中可能有QGP生成提供了一个旁证.     

Stability of Runge-Kutta methods for delay differential systems with multiple delays

The stability of Runge-Kutta methods for systems of delay differentialequations (DDEs) with multiple delays is considered. The stabilityregions of explicit and implicit Runge-Kutta methods are discussedwhen they are applied to asymptotically stable linear DDEs withmultiple delays. A simple estimate on the stability regionsof explicit Runge-Kutta methods is presented. It is shown thatthe stable step-size for numerical integration of DDEs withmultiple delays can be easily selected by means of the estimate.     

ee0A GeV S+Au反应中光子产生的低横动量增强

用建立在LUND弦模型特别是PYTHIA事件产生器基础上的描写极端相对论性核一核碰撞的强子和弦级联模型—JPCIAE研究了入射能量为200A GeV的S+ Au中心碰撞中光子产生.模型同时考虑了部分子QCD散射过程、强子末态相互作用以及强子衰变等光子产生反应道并作了协调处理.JPCIAE模型计算结果很好再现了WA93实验数据所呈现的低横动量增强效应.