Digital total variation filtering as postprocessing for Chebyshev pseudospectral methods for conservation laws

Digital total variation filtering is analyzed as a fast, robust, post-processing method for accelerating the convergence of pseudospectral approximations that have been contaminated by Gibbs oscillations. The method, which originated in image processing, can be combined with spectral filters to quickly post-process large data sets with sharp resolution of discontinuities and with exponential accuracy away from the discontinuities.     

任意挠曲输液管道瞬时变分原理

给出了弹性系统瞬时势能泛函的一般表达式，得到了其关于任意挠曲输液管道的具体表达式，根据瞬时最小势能原理建立了该结构的有限元动力方程，并首次推导出其离心力载荷公式，讨论了管道结构静平衡位置的发散流速的确定，最后，用简单的实验结果对理论分析作了验证。     

耦合热弹性问题的分区变分原理及其广义变分原理

本文在文献[1]和[2]的基础上建立并论证了耦合热弹性问题的分区变分原理及其分区广义变分原理     

Tutorial review on validation of liquid chromatography–mass spectrometry methods: Part I

This is the part I of a tutorial review intending to give an overview of the state of the art of method validation in liquid chromatography mass spectrometry (LC–MS) and discuss specific issues that arise with MS (and MS/MS) detection in LC (as opposed to the “conventional” detectors). The Part I briefly introduces the principles of operation of LC–MS (emphasizing the aspects important from the validation point of view, in particular the ionization process and ionization suppression/enhancement); reviews the main validation guideline documents and discusses in detail the following performance parameters: selectivity/specificity/identity, ruggedness/robustness, limit of detection, limit of quantification, decision limit and detection capability. With every method performance characteristic its essence and terminology are addressed, the current status of treating it is reviewed and recommendations are given, how to determine it, specifically in the case of LC–MS methods.     

刚架结构变更定理与极限状态函数的连续生成

本文基于计算结构力学概念提出了刚架结构连续变更定理,用数值分析与递推公式相结合的方法连续生成结构极限状态函数,给出了结构退化为机构的新判据。由于引用了计算结构力学方法,重分析不必重新形成结构刚度阵,不必反复求逆矩阵,大大提高了计算效率。     

Computational analysis for the determination of deleterious nsSNPs in human MTHFD1 gene

Single nucleotide polymorphisms (SNPs) are the most common genetic polymorphisms and play a major role in many inherited diseases. Methylenetetrahydrofolate dehydrogenase 1 (MTHFD1) is one of the enzymes involved in folate metabolism. In the present study, the functional and structural consequences of nsSNPs of human MTHFD1 gene was analyzed using various computational tools like SIFT, PolyPhen2, PANTHER, PROVEAN, SNAP2, nsSNPAnalyzer, PhD-SNP, SNPs&GO, I-Mutant, MuPro, ConSurf, InterPro, NCBI Conserved Domain Search tool, ModPred, SPARKS-X, RAMPAGE, FT Site and PyMol. Out of 327 nsSNPs form human MTHFD1 gene, total 45 SNPs were predicted as functionally most significant SNPs, among which 17 were highly conserved and functional, 17 were highly conserved and structural residues. Among 45 most significant SNPs, 15 were predicted to be involved in post translational modifications. The p.Gly165Arg may interfere in homodimer interface formation. The p.Asn439Lys and p.Asp445Asn may interfere in binding interactions of MTHFD1 protein with cesium cation and potassium. The two SNPs (p.Asp562Gly and p.Gly637Cys) might interfere in interactions of MTHFD1 with ligand.     

Limit theorems for random walks

We consider a random walk $S_{\tau }$ which is obtained from the simple random walk $S$ by a discrete time version of Bochner’s subordination. We prove that under certain conditions on the subordinator $\tau$ appropriately scaled random walk $S_{\tau }$ converges in the Skorohod space to the symmetric $\alpha$-stable process $B^{\alpha }$. We also prove asymptotic formula for the transition function of $S_{\tau }$ similar to the Pólya’s asymptotic formula for $B^{\alpha }$.     

多失效模式重要抽样法的方差分析及应用

在计算结构体系失效概率时,基于Monte-Carlo数值模拟的重要抽样技术已被实践证明是一种非常有效的方法。重要抽样法中估计量的方差是影响收敛速度和计算精度的重要指标,因此重要抽样法的方差分析是非常必要的。对于单模式而言,其方差分析比较容易。对于多模式情况,其方差分析有一定的困难。这有可能影响重要抽样法在多模式结构体系失效概率计算中的应用。本文详细推导了几种常见重要抽样法的方差计算公式。然后用方差分析的概念,阐明了多模式重要抽样法应用中的一些问题。     

一种新的摄动粘弹性边界元法

本文在拉普拉斯变换空间中,运用摄动理论和“弹性-粘弹性”对应性原理,提出了一种新的粘弹性问题边界元求解法。文中结合广义变分原理,导出了摄动粘弹性边界元方程,并给出了摄动粘弹性问题的基本解。最后,详述了一阶摄动的求解过程,并给出了算例。     

地表温度对颗粒跃移轨迹的影响

为了研究由地表温度变化引起的向上的垂向气流对沙粒跃移运动的影响,本文给出了考虑近地表温度变化和水平来流风场作用下的沙粒的跃移运动。在定量给出不同时刻的近地表温度和垂向风速的基础上,计算了由于太阳辐射所引起的近地表层垂向气流对沙粒跃移运动的影响,发现:垂向风速在午后可达到1.5m/s并使得沙粒跃移轨迹的最大高度和长度分别增加55.56%和73.68%;同时,与不考虑温度效应的情况不同的是,沙粒跃移轨道最大高度将随粒径变化。