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11.
在产品质量判定的抽样检验问题中,当目标指标需用破坏性试验才能得其值时,更为常用的是用非破坏性试验可得量值的协变指标量来预报它。但在产品抽样验收问题上,未能形成理论较为严密的方法,这是由于预报误差这个关键问题的处理尚未解决得好,即给不出抽样方案的功效计算的正确或是近似性较好的公式。本文通过建立合理的数学模型,把对目标指标的质量要求化为对协变指标量的统计要求,从而利用两者的回归关系,结合两种复杂的抽样方案,给出功效函数的计算公式和计算方法,并进行了分析。 相似文献
12.
Fatty acids, which are enriched in vegetable oil, have attracted much attention in low-rank coal flotation because of their unique chemical structure. In this study, density functional theory calculations, molecular dynamics simulations, and atomic force microscopy were employed to investigate the adsorption structure and forces between collectors and hydrophilic surfaces. The results show that fatty acids can be easily adsorbed onto surfaces through hydrogen bonds, and can cover the oxygen sites. The existence of hydration film on hydrophilic surfaces prevented nonpolar molecules from being able to adsorb, while polar fatty acids could adsorb and expel water molecules. The adhesion force between the RCOOH-terminated probe and the surface appeared in the retraction process, which differed significantly from that of the RCH3-terminated probe, indicating that polar fatty acids are more suitable as flotation collectors for low-rank coal than nonpolar hydrocarbon oil. The simulation and AFM test revealed the mechanisms of polar fatty acids, and can provide guidance for low-rank coal flotation applications. 相似文献
13.
We here outline the importance of open-source, accessible tools for computer-aided drug discovery (CADD). We begin with a discussion of drug discovery in general to provide context for a subsequent discussion of structure-based CADD applied to small-molecule ligand discovery. Next, we identify usability challenges common to many open-source CADD tools. To address these challenges, we propose a browser-based approach to CADD tool deployment in which CADD calculations run in modern web browsers on users’ local computers. The browser app approach eliminates the need for user-initiated download and installation, ensures broad operating system compatibility, enables easy updates, and provides a user-friendly graphical user interface. Unlike server apps—which run calculations “in the cloud” rather than on users’ local computers—browser apps do not require users to upload proprietary information to a third-party (remote) server. They also eliminate the need for the difficult-to-maintain computer infrastructure required to run user-initiated calculations remotely. We conclude by describing some CADD browser apps developed in our lab, which illustrate the utility of this approach. Aside from introducing readers to these specific tools, we are hopeful that this review highlights the need for additional browser-compatible, user-friendly CADD software. 相似文献
14.
F. L. Vook 《辐射效应与固体损伤》2013,168(3-4):155-160
This paper was given as the opening address at the 1970 Albany International Conference on Radiation Effects in Semiconductors, and it attempts to establish a general overview of the field by concentrating on recent research developments and important unanswered questions. The continuing importance of impurity-defect interactions, of microscopic defect identification, and of the necessity for more theoretical calculations are emphasized. The rapid development of the field of ion implantation and its close relationship with radiation effects studies are pointed out. It is predicted that research in compound semiconductors will increase rapidly with close beneficial interaction with ion implantation studies. 相似文献
15.
In a previous paper we studied the Young's and shear modulus of a high-angle twist grain boundary (5) in Cu, using the EAM, and related it to the uniaxial strain derivatives of single crystals. In this paper, we discuss elastic properties of ten additional twist grain boundaries, from 8.8–43.6°. The monolayer Young's modulus at each boundary was calculated and found to be 20–50% higher than the bulk value for all eleven boundaries for both csl and type1 structures. The monolayer shear modulus at each boundary was calculated and found to be 93–98% lower than the bulk value for six grain boundaries with csl structure and found to decrease with increasing twist angle. The critical shear stress was also calculated for eleven boundaries with csl structure and found to roughly decrease with increasing twist angle. 相似文献
16.
本文根据电化学方法研究配合物的特性,设计了一个计算配合物稳定常数的通用程序,其程序用BASIC语言编写。此程序能用于电位溶出法、极谱法和电势法研究配合物的实验数据处理。 相似文献
17.
We introduce the concept of partially strictly monotone functions and apply it to construct a class of nonlinear penalty functions for a constrained optimization problem. This class of nonlinear penalty functions includes some (nonlinear) penalty functions currently used in the literature as special cases. Assuming that the perturbation function is lower semi-continuous, we prove that the sequence of optimal values of nonlinear penalty problems converges to that of the original constrained optimization problem. First-order and second-order necessary optimality conditions of nonlinear penalty problems are derived by converting the optimality of penalty problems into that of a smooth constrained vector optimization problem. This approach allows for a concise derivation of optimality conditions of nonlinear penalty problems. Finally, we prove that each limit point of the second-order stationary points of the nonlinear penalty problems is a second-order stationary point of the original constrained optimization problem. 相似文献
18.
Local branching 总被引:1,自引:0,他引:1
The availability of effective exact or heuristic solution methods for general Mixed-Integer Programs (MIPs) is of paramount importance for practical applications. In the present paper we investigate the use of a generic MIP solver as a black-box ``tactical' tool to explore effectively suitable solution subspaces defined and controlled at a ``strategic' level by a simple external branching framework. The procedure is in the spirit of well-known local search metaheuristics, but the neighborhoods are obtained through the introduction in the MIP model of completely general linear inequalities called local branching cuts. The new solution strategy is exact in nature, though it is designed to improve the heuristic behavior of the MIP solver at hand. It alternates high-level strategic branchings to define the solution neighborhoods, and low-level tactical branchings to explore them. The result is a completely general scheme aimed at favoring early updatings of the incumbent solution, hence producing high-quality solutions at early stages of the computation. The method is analyzed computationally on a large class of very difficult MIP problems by using the state-of-the-art commercial software ILOG-Cplex 7.0 as the black-box tactical MIP solver. For these instances, most of which cannot be solved to proven optimality in a reasonable time, the new method exhibits consistently an improved heuristic performance: in 23 out of 29 cases, the MIP solver produced significantly better incumbent solutions when driven by the local branching paradigm.
Mathematics Subject Classification (2000):90C06, 90C10, 90C11, 90C27, 90C59 相似文献
19.
The affine-scaling algorithm, first proposed by Dikin, is presently enjoying great popularity as a potentially effective means of solving linear programs. An outstanding question about this algorithm concerns its convergence in the presence of degeneracy. In this paper, we give new convergence results for this algorithm that do not require any non-degeneracy assumption on the problem. In particular, we show that if the stepsize choice of either Dikin or Barnes or Vanderbei, et al. is used, then the algorithm generates iterates that converge at least linearly with a convergence ratio of
, wheren is the number of variables and (0,1] is a certain stepsize ratio. For one particular stepsize choice which is an extension of that of Barnes, we show that the cost of the limit point is within O(/(1–)) of the optimal cost and, for sufficiently small (roughly, proportional to how close the cost of the nonoptimal vertices are to the optimal cost), is exactly optimal. We prove the latter result by using an unusual proof technique, that of analyzing the ergodic convergence of the corresponding dual vectors. For the special case of network flow problems with integer data, we show that it suffices to take = 1/(6mC), wherem is the number of constraints andC is the sum of the cost coefficients, to attain exact optimality.This research is partially supported by the U.S. Army Research Office, contract DAAL03-86-K-0171 (Center for Intelligent Control Systems), by the National Science Foundation, grant NSF-ECS-8519058, and by the Science and Engineering Research Board of McMaster University. 相似文献
20.
一种新的三维计算全息图的计算方法 总被引:1,自引:0,他引:1
介绍了一种制作真实三维物体计算全息图的新方法。用摄像机记录三维物体在非相干光照明条件下两个正交方向上不同视角的一系列投影像,将这些投影像导入计算机,在MATLAB中对其作快速傅里叶变换。对这一系列二维投影像的傅里叶变换图进行抽样,得到三维物体在透镜后焦平面上的光场分布,进而制成一张计算全息图。结果证明该方法可以实现对真实物体三维全息图的合成,并且在算法实现上更加简单,提高了程序的运行速度,有利于改善全息图再现像的质量。为解决真实物体相干全息记录中光源功率和相干长度对全息记录可行性的限制指出了一个新的方向。 相似文献