Fragmentation studies of pentacoordinated bisaminoacylspirophosphoranes by negative electrospray ionization mass spectrometry

Fragmentation pathways of a series of pentacoordinated bisaminoacylspirophosphoranes were elucidated by electrospray ionization multistage mass spectrometry (ESI-MS(n)) in negative mode. The deprotonated ions of pentacoordinated bisaminoacylspirophosphoranes tend to eliminate a corresponding amino acid to form base peak. The hydrogen/deuterium exchange experiment, the high-resolution mass spectrometry, (13)C stable isotope labeling experiment and theoretical calculations were used to rationalize the proposed fragmentation pathways and to verify the differences between the fragmentation pathways. The results indicate that the negative molecular ions of pentacoordinated bisaminoacylspirophosphoranes dissociate through its open-chain tricoordinated tautomers. The relative Gibbs free energies (ΔG) of the product ions and proposed fragmentation pathways were estimated using the B3LYP/6-31 + + G(d, p) model. The results have some potential applications in the identification structures of similar spirophosphorane compounds by ESI-MS(n).     

核酸工具酶辅助的金属稳定同位素标记方法在生物分析中的应用

本文主要概述了近年来核酸工具酶辅助的基于金属稳定同位素标记的电感耦合等离子体质谱(ICP-MS)检测方法在生物分析中的发展和应用,简要介绍了该方法在蛋白质、核酸及一些生物小分子检测中的应用。最后对核酸工具酶辅助的基于金属稳定同位素标记的电感耦合等离子体质谱(ICP-MS)检测方法的发展前景做了展望。     

LJ团簇和H2O团簇的局域优化计算

将传统分子动力学方法中时间积分步长定义成粒子的最大加速度、最大速度和变化的最大允许空间步长的函数,并给出了空间步长的确定方法.作为对这个算法有效性的检验,计算了较小Lennard-Jones团簇和H₂O团簇的稳定结构,发现了新的(H₂O)₁₃的最小能结构.     

ROBUST WEAK ERGODICITY AND STABLE ERGODICITY

In this paper, we define robust weak ergodicity and study the relation between robust weak ergodicity and stable ergodicity for conservative partially hyperbolic systems. We prove that a Cr(r > 1) cons...     

基于进化博弈视角的水源地与下游生态补偿合作演化分析

水源地与下游地方政府之间的协议合作可以协调流域上下游之间的矛盾和利益,是一种可实现流域生态保护良性循环的生态补偿尝试。本文应用进化博弈的双种群博弈理论,研究了水源地和下游地方政府之间博弈演化过程及影响因素。研究表明,流域上下游地方政府合作的演化方向主要受水源地不保护及下游不补偿受到的惩罚、下游对水源地的补偿额度、水源地和下游合作的初始成本、水源地生态保护的成本及收益等八个因素的影响。降低水源地的保护成本及水源地和下游合作的初始成本,提高水源地因保护而获得的综合效益、提高水源地不保护及下游不补偿受到的惩罚额度、合理确定下游对水源地的补偿额度将有利于水源地生态补偿机制向合作方向演进。     

一类中立型时变非线性控制系统的镇定与控制

本文利用专著（１）￣（３）中的有关方法,讨论了一类具有滞后的中立型时变非线性控制系统的镇定与次优控制问题,得出了滞后量与非线性项的估计公式,并推广了文（４）,（５）的结果。     

监测L\'{e}vy稳定过程均值变点的平均运行时间估计

平均运行长度(时间) (ARL)是判断一控制图监测变点效果好坏的一个重要工具\bd 本文主要研究L\'{e}vy 稳定过程的均值变点监测问题\bd 我们给出了三个控制图, 即EWMA, GEWMA和GLR的ARL 估计, 并通过数值模拟比较了4个控制图监测均值变点的效果和差异.     

Smooth equivalence of differential equations and linear automorphisms

For systems of ordinary differential equations admitting linear automorphisms, we consider the problems of smooth equivalence and linearization preserving these automorphisms. Translated fromMatematicheskie Zametki, Vol. 66, No. 4, pp. 567–578, October, 1999.     

多项式环的单位和稳定度的注记

称环R为广义2-素环,如果R的幂零元集与上诣零根一致.证明了R上的多项式为单位当且仅当它的常数项是R中的单位而其它系数是幂零的.因此,广义2-素环上的多项式环的稳定度大于一.     

Computerprogramm zur interaktiven Auswertung von 15N-tracerkinetischen Stoffwechselexperimenten

The theoretical concept of the computer program is based on the compartment theory for the 3-pool model using single pulse administration of the tracer. The code estimates the model parameters by means of the non-linear method of least squares fit under steady state conditions. Furthermore the parameters of the protein metabolism are calculated. The program works interactively and allows reading and modifying the experimental ¹⁵N tracer data via terminal and controlling the program.