具有反铁磁相互作用的双铁磁链中的非线性激发

采用双子格模型和相干态表示,研究了链与链之间存在反铁磁相互作用的双铁磁链系统中的非线性激发的性质,得到了孤子的宽度,能量及有效质量。结果表明在不同情况下的各向异性双铁磁链中可以激发拓扑性孤子或非拓性孤子或非拓生反孤子。     

Mn（Ⅱ）,Co（Ⅱ）与HSA相互作用的荧光光谱研究

用荧光光谱法研究了生理ｐＨ和等离子点（ｐＨ＝５．３０）时Ｍｎ（Ⅱ）、Ｃｏ（Ⅱ）与ＨＳＡ的相互作用。根据Ｆｏｒｓｔｅ非辐射能量转移理论,得到了不同ｐＨ时Ｍｎ（Ⅱ）、Ｃｏ（Ⅱ）在ＨＳＡ中的第一强结合位置与Ｔｒｐ－２１４残基间的距离。这一结果远大于文献报道值,根据Ｍｎ（Ⅱ）、Ｃｏ（Ⅱ）在ＨＳＡ中的结合部位及ＨＳＡ的畴结构对这一显著差异进行了讨论。     

Kinetically Controlled Solid State Reactions in the System InCl3/Sn

This paper reports on studies on the reactivity of metallic Sn in a solid state reaction in the system In‐Sn‐Cl. The reaction route is investigated by thermoanalysis and XRD measurements. The reaction of InCl₃ with Sn to form InSnCl₃ does not proceed directly but in several steps giving 4 intermediate phases. It can be interpreted as a kinetically controlled reaction where intermediate phases with a smaller degree of order and higher diffusivity are preferentially formed outside thermodynamic equilibria.     

Cu50Ni50合金快速凝固的分子动力学模拟

采用分子动力学模拟的方法研究了Cu₅₀Ni₅₀合金在不同冷却速度下的凝固过程,利用均方位移、径向分布函数和结构可视化等方法分析其微观结构.并对凝固模型进行拉伸模拟,通过应力应变曲线和直观结构变化分析其性能.研究表明：冷却速度对Cu₅₀Ni₅₀合金凝固形成的结构有较大影响,随着冷却速度的升高,凝固形成的结构中晶体含量减少,在较低的冷却速度下,如冷却1×10¹²K/s时,Cu₅₀Ni₅₀合金凝固形成晶体结构;在较高的冷却速度下,如1×10¹⁴K/s时,Cu₅₀Ni₅₀合金凝固形成非晶体结构,且非晶Cu₅₀Ni₅₀合金的抗拉性能要优于晶体Cu₅₀Ni₅₀合金.     

Instabilité d'une nappe de vorticité étirée instationnaireInstability of an unsteady stretched vortex layer

We consider how the Kelvin–Helmholtz instability is affected by an external hyperbolic strain flow. The basic flow being unsteady, the inviscid evolution of perturbations is studied within the framework of a non-normal analysis in which the maximum amplification is computed for any given time. A positive or negative stretching is shown to enhance or reduce, respectively, the instability even for weak stretching rates. To cite this article: T. Gomez, M. Rossi, C. R. Mecanique 331 (2003).     

ON THE MINIMAL PERIOD FOR PERIODIC SOLUTION PROBLEM OF NONLINEAR HAMILTONIAN SYSTEMS

ＯＮＴＨＥＭＩＮＩＭＡＬＰＥＲＩＯＤＦＯＲＰＥＲＩＯＤＩＣＳＯＬＵＴＩＯＮＰＲＯＢＬＥＭＯＦＮＯＮＬＩＮＥＡＲＨＡＭＩＬＴＯＮＩＡＮＳＹＳＴＥＭＳ＊＊ＬＯＮＧＹＩＭＩＮＧ＊ＡｂｓｔｒａｃｔＴｈｅａｕｔｈｏｒｐｒｏｖｅｓａｓｈａｒｐｅｒｅｓｔｉｍａｔｅ...     

增长曲线模型中参数估计的一个注记

对于具有序列协方差结构的正态增长曲线模型，证明了在一定条件下不存在方差的一致最小无偏估计。给出了在任意凸损失下存在回归系数矩阵的任何线性可估函数的一致最小风险无偏估计的另一个充要条件。     

低剂量三氯化钐对实验性非胰岛素依赖型糖尿病大鼠胰岛的影响

观察了经腹腔注射低剂量三氯化钐（０．０５ｍｇ／ｋｇ）对链脲佐菌素引志的非胰岛素依赖型糖尿病（ＮＤＩＤＤＭ）大鼠胰岛形态和功能的影响。结果表明，三氯化钐治疗组糖耐量改善、血清胰岛水平长高、血清胰镐血糖素水平降低、平均单个胰岛面积和胰岛β细胞数量明显增多，肝细胞内糖原含量增多。提示低剂量三氯化钐对实验性ＮＩＤＤＭ大鼠有一定的治疗作用。     

Structure‐Based Design and Synthesis of the First Weak Non‐Phosphate Inhibitors for IspF,an Enzyme in the Non‐Mevalonate Pathway of Isoprenoid Biosynthesis

In this paper, we describe the structure‐based design, synthesis, and biological evaluation of cytosine derivatives and analogues that inhibit IspF, an enzyme in the non‐mevalonate pathway of isoprenoid biosynthesis. This pathway is responsible for the biosynthesis of the C₅ precursors to isoprenoids, isopentenyl diphosphate (IPP, 1 ) and dimethylallyl diphosphate (DMAPP, 2 ; Scheme 1). The non‐mevalonate pathway is the sole source for 1 and 2 in the protozoan Plasmodium parasites. Since mammals exclusively utilize the alternative mevalonate pathway, the enzymes of the non‐mevalonate pathway have been identified as attractive new drug targets in the fight against malaria. Based on computer modeling (cf. Figs. 2 and 3), new cytosine derivatives and analogues (Fig. 1) were selected as potential drug‐like inhibitors of IspF protein, and synthesized (Schemes 2–5). Determination of the enzyme activity by ¹³C‐NMR spectroscopy in the presence of the new ligands showed inhibitory activities for some of the prepared cytosine and pyridine‐2,5‐diamine derivatives in the upper micromolar range (IC₅₀ values; Table). The data suggest that it is possible to inhibit IspF protein without binding to the polar diphosphate binding site and the side chain of Asp56′, which interacts with the ribose moiety of the substrate and substrate analogues. Furthermore, a new spacious sub‐pocket was discovered which accommodates aromatic spacers between cytosine derivatives or analogues (binding to ‘Pocket III’) and rings that occupy the flexible hydrophobic region of ‘Pocket II’. The proposed binding mode remains to be further validated by X‐ray crystallography.     

有机质子和有机水溶剂中有机酸pKa值的测定与玻璃电极的标定

在非水质子溶剂和有机．水溶液中有机酸的酸碱平衡常数测定精度与质子浓度的测定精度密切相关。溶液中质子活度可以用水标准溶液标定的玻璃电极用电位法来测定。测得的以水为标准的质子活度pHm,可用-log[H2S^＋]=pHm-（-logγ-D）来转换成质子的浓度，（-logγ-D）是一个与该溶剂有关的常数。用非线性回归法对有机酸的质子交换数与质子溶度关系模拟可以进一步提高有机酸酸度测定的精度。