Cryo-EM image alignment based on nonuniform fast Fourier transform

In single particle analysis, two-dimensional (2-D) alignment is a fundamental step intended to put into register various particle projections of biological macromolecules collected at the electron microscope. The efficiency and quality of three-dimensional (3-D) structure reconstruction largely depends on the computational speed and alignment accuracy of this crucial step. In order to improve the performance of alignment, we introduce a new method that takes advantage of the highly accurate interpolation scheme based on the gridding method, a version of the nonuniform fast Fourier transform, and utilizes a multi-dimensional optimization algorithm for the refinement of the orientation parameters. Using simulated data, we demonstrate that by using less than half of the sample points and taking twice the runtime, our new 2-D alignment method achieves dramatically better alignment accuracy than that based on quadratic interpolation. We also apply our method to image to volume registration, the key step in the single particle EM structure refinement protocol. We find that in this case the accuracy of the method not only surpasses the accuracy of the commonly used real-space implementation, but results are achieved in much shorter time, making gridding-based alignment a perfect candidate for efficient structure determination in single particle analysis.     

考虑电-氢-热多能互补的微网多目标优化配置研究

氢储能具有储能容量大、储存时间长、清洁无污染、实现多种能源网络互联互补和协同优化等诸多优点,有望成为推动分布式能源发展和提升终端能源利用效率的重要支撑技术。为了提高独立型微网供电可靠性及可再生能源利用率,本文建立了考虑电-氢-热多能互补的独立微网多目标优化配置模型,并基于模拟退火的粒子群算法对目标问题进行求解。最后,通过东北某地独立微网优化配置算例,基于MATLAB平台验证了所提多能互补配置方案较传统电储能配置方案负荷失电率降低了3.18%,可再生能源利用率提高了8.37%,所提配置方案可有效促进可再生能源消纳,保证独立微网的供电可靠性。     

Reconstructing design parameters of a rectangular resonator via peak signal-to-noise ratio and global optimization algorithms

This article proposes an approach for reconstructing physical parameters of a sample in a rectangular resonator during microwave radiation, knowing a priori, its electric field distribution. The inverse problem was solved using two global optimization algorithms and the peak signal-to-noise ratio (PSNR) criterion. First, the Self-regulated Fretwidth Harmony Search algorithm (SFHS) identified suitable resonant frequencies for a given configuration. Next, the unified Particle Swarm Optimization (UPSO) optimized said configuration. Together, they became a maximization strategy of the PSNR through a dual optimization process. Results showed the ability of the approach for estimating the height of each sample block and the resonating frequency of the cavity. This process takes longer to finish as a higher PSNR is demanded (mainly due to the aforementioned dual optimization). Even so, it allows for more similar electric field distributions between both, the direct and inverse problems.     

Erosion coupled dynamic mesh analysis for location of maximum erosion in 90-degree bends for gas-solid flows

The progressive change in the surface geometry of the component due to erosive wear affects the correct estimation of erosive wear performance and service life of the components handling particulate flows. The current study focuses on determining the change in the location of higher erosion on the bend surface during the pneumatic conveying of solids with continuous geometric modification due to erosive wear. Computational fluid dynamics (CFD) based erosion-coupled dynamic mesh methodology is adopted to simulate the time-dependent surface modification of the 90° bend geometry due to erosive wear. Available experimental data are used to validate the numerical results. Further, the erosion distribution and the location of the maximum erosion for different flow velocities, particle sizes, and bend radius ratios with the increase in solid throughput are investigated. It has been found that the modification in the bend geometry due to erosion influences the location of the maximum erosion. The increase in thickness loss due to erosion increases the variation in the location of the maximum erosion. Furthermore, an equation for predicting the location of maximum erosion of bend geometry is obtained based on the bend radius ratio and the thickness loss.     

The first measurement of an absolute surface concentration of reaction intermediates in ethylene hydrogenation

The first measurement of a turnover rate with respect to surface intermediate concentration in a high pressure heterogeneous catalytic reaction is reported. By using infrared-visible sum frequency generation to study the hydrogenation of ethylene on Pt(111), it was found that the surface concentration of -bonded ethylene, the key reaction intermediate, represented approximately 4% of a monolayer. Thus the absolute turnover rate per surface adsorbed ethylene molecule is 25 times faster than the rate measured per platinum atom. To explain these results, we propose a model of weakly adsorbed ethylene intermediates reacting on atop sites.     

EDA9033A在分布式风机性能测试系统中的应用

针对以单片机为核心的风机性能测试系统存在稳定性差、抗干扰能力差、精度低等问题,开发了以PLC为核心、采用互感式采集模块EDA9033A采集风机电参数的分布式风机性能测试系统,给出了该风机性能测试系统的结构,详细介绍了EDA9033A的硬件及软件设计。实际应用表明,EDA9033A采集的风机电参数结果稳定、快速、准确。     

Discrete particle swarm optimization based on estimation of distribution for terminal assignment problems

Terminal assignment problem (TEAP) is to determine minimum cost links to form a network by connecting a given set of terminals to a given collection of concentrators. This paper presents a novel discrete particle swarm optimization (PSO) based on estimation of distribution (EDA), named DPSO-EDA, for TEAP. EDAs sample new solutions from a probability model which characterizes the distribution of promising solutions in the search space at each generation. The DPSO-EDA incorporates the global statistical information collected from personal best solutions of all particles into the PSO, and therefore each particle has comprehensive learning and search ability. In the DPSO-EDA, a modified constraint handling method based on Hopfield neural network (HNN) is also introduced to fit nicely into the framework of the PSO and thus utilize the merit of the PSO. The DPSO-EDA adopts the asynchronous updating scheme. Further, the DPSO-EDA is applied to a problem directly related to TEAP, the task assignment problem (TAAP), in order to show that the DPSO-EDA can be generalized to other related combinatorial optimization problems. Simulation results on several problem instances show that the DPSO-EDA is better than previous methods.     

Checking determinism of XML Schema content models in optimal time

We consider the determinism checking of XML Schema content models, as required by the W3C Recommendation. We argue that currently applied solutions have flaws and make processors vulnerable to exponential resource needs by pathological schemas, and we help to eliminate this potential vulnerability of XML Schema based systems. XML Schema content models are essentially regular expressions extended with numeric occurrence indicators. A previously published polynomial-time solution to check the determinism of such expressions is improved to run in linear time, and the improved algorithm is implemented and evaluated experimentally. When compared to the corresponding method of a popular production-quality XML Schema processor, the new implementation runs orders of magnitude faster. Enhancing the solution to take further extensions of XML Schema into account without compromising its linear scalability is also discussed.     

Further results of recursive evaluation for compound distribution with the severity distribution of mixed type

Yang et al. [J.P. Yang, S.H. Cheng, Q. Wu, Recursive equations for compound distribution with the severity distribution of the mixed type, Science in China Series A 48 (2005) 594-609] investigated a recursive procedure for a kind of compound distributions with the number of claims belonging to (a,b)-family and the severity distribution of the mixed type. In this paper, we extend their results by assuming that the claim number belongs to a larger class. As applications, the excess-of-loss reinsurance treaty is discussed and concrete examples are considered in some detail.