Результаты поиска по 'complexation':
Найдено статей: 245
  1. Shepelev V.V., Fortova S.V., Oparina E.I.
    Application of Turbulence Problem Solver (TPS) software complex for numerical modeling of the interaction between laser radiation and metals
    Computer Research and Modeling, 2018, v. 10, no. 5, pp. 619-630

    The work is dedicated to the use of the software package Turbulence Problem Solver (TPS) for numerical simulation of a wide range of laser problems. The capabilities of the package are demonstrated by the example of numerical simulation of the interaction of femtosecond laser pulses with thin metal bonds. The software package TPS developed by the authors is intended for numerical solution of hyperbolic systems of differential equations on multiprocessor computing systems with distributed memory. The package is a modern and expandable software product. The architecture of the package gives the researcher the opportunity to model different physical processes in a uniform way, using different numerical methods and program blocks containing specific initial conditions, boundary conditions and source terms for each problem. The package provides the the opportunity to expand the functionality of the package by adding new classes of problems, computational methods, initial and boundary conditions, as well as equations of state of matter. The numerical methods implemented in the software package were tested on test problems in one-dimensional, two-dimensional and three-dimensional geometry, which included Riemann's problems on the decay of an arbitrary discontinuity with different configurations of the exact solution.

    Thin films on substrates are an important class of targets for nanomodification of surfaces in plasmonics or sensor applications. Many articles are devoted to this subject. Most of them, however, focus on the dynamics of the film itself, paying little attention to the substrate, considering it simply as an object that absorbs the first compression wave and does not affect the surface structures that arise as a result of irradiation. The paper describes in detail a computational experiment on the numerical simulation of the interaction of a single ultrashort laser pulse with a gold film deposited on a thick glass substrate. The uniform rectangular grid and the first-order Godunov numerical method were used. The presented results of calculations allowed to confirm the theory of the shock-wave mechanism of holes formation in the metal under femtosecond laser action for the case of a thin gold film with a thickness of about 50 nm on a thick glass substrate.

    Views (last year): 15.
  2. Usanov M.S., Kulberg N.S., Morozov S.P.
    Development of anisotropic nonlinear noise-reduction algorithm for computed tomography data with context dynamic threshold
    Computer Research and Modeling, 2019, v. 11, no. 2, pp. 233-248

    The article deals with the development of the noise-reduction algorithm based on anisotropic nonlinear data filtering of computed tomography (CT). Analysis of domestic and foreign literature has shown that the most effective algorithms for noise reduction of CT data use complex methods for analyzing and processing data, such as bilateral, adaptive, three-dimensional and other types of filtrations. However, a combination of such techniques is rarely used in practice due to long processing time per slice. In this regard, it was decided to develop an efficient and fast algorithm for noise-reduction based on simplified bilateral filtration method with three-dimensional data accumulation. The algorithm was developed on C ++11 programming language in Microsoft Visual Studio 2015. The main difference of the developed noise reduction algorithm is the use an improved mathematical model of CT noise, based on the distribution of Poisson and Gauss from the logarithmic value, developed earlier by our team. This allows a more accurate determination of the noise level and, thus, the threshold of data processing. As the result of the noise reduction algorithm, processed CT data with lower noise level were obtained. Visual evaluation of the data showed the increased information content of the processed data, compared to original data, the clarity of the mapping of homogeneous regions, and a significant reduction in noise in processing areas. Assessing the numerical results of the algorithm showed a decrease in the standard deviation (SD) level by more than 6 times in the processed areas, and high rates of the determination coefficient showed that the data were not distorted and changed only due to the removal of noise. Usage of newly developed context dynamic threshold made it possible to decrease SD level on every area of data. The main difference of the developed threshold is its simplicity and speed, achieved by preliminary estimation of the data array and derivation of the threshold values that are put in correspondence with each pixel of the CT. The principle of its work is based on threshold criteria, which fits well both into the developed noise reduction algorithm based on anisotropic nonlinear filtration, and another algorithm of noise-reduction. The algorithm successfully functions as part of the MultiVox workstation and is being prepared for implementation in a single radiological network of the city of Moscow.

    Views (last year): 21.
  3. Madera A.G.
    Hierarchical method for mathematical modeling of stochastic thermal processes in complex electronic systems
    Computer Research and Modeling, 2019, v. 11, no. 4, pp. 613-630

    A hierarchical method of mathematical and computer modeling of interval-stochastic thermal processes in complex electronic systems for various purposes is developed. The developed concept of hierarchical structuring reflects both the constructive hierarchy of a complex electronic system and the hierarchy of mathematical models of heat exchange processes. Thermal processes that take into account various physical phenomena in complex electronic systems are described by systems of stochastic, unsteady, and nonlinear partial differential equations and, therefore, their computer simulation encounters considerable computational difficulties even with the use of supercomputers. The hierarchical method avoids these difficulties. The hierarchical structure of the electronic system design, in general, is characterized by five levels: Level 1 — the active elements of the ES (microcircuits, electro-radio-elements); Level 2 — electronic module; Level 3 — a panel that combines a variety of electronic modules; Level 4 — a block of panels; Level 5 — stand installed in a stationary or mobile room. The hierarchy of models and modeling of stochastic thermal processes is constructed in the reverse order of the hierarchical structure of the electronic system design, while the modeling of interval-stochastic thermal processes is carried out by obtaining equations for statistical measures. The hierarchical method developed in the article allows to take into account the principal features of thermal processes, such as the stochastic nature of thermal, electrical and design factors in the production, assembly and installation of electronic systems, stochastic scatter of operating conditions and the environment, non-linear temperature dependencies of heat exchange factors, unsteady nature of thermal processes. The equations obtained in the article for statistical measures of stochastic thermal processes are a system of 14 non-stationary nonlinear differential equations of the first order in ordinary derivatives, whose solution is easily implemented on modern computers by existing numerical methods. The results of applying the method for computer simulation of stochastic thermal processes in electron systems are considered. The hierarchical method is applied in practice for the thermal design of real electronic systems and the creation of modern competitive devices.

    Views (last year): 3.
  4. Sukhinov A.I., Chistyakov A.E., Protsenko E.A.
    Difference scheme for solving problems of hydrodynamics for large grid Peclet numbers
    Computer Research and Modeling, 2019, v. 11, no. 5, pp. 833-848

    The paper discusses the development and application of the accounting rectangular cell fullness method with material substance, in particular, a liquid, to increase the smoothness and accuracy of a finite-difference solution of hydrodynamic problems with a complex shape of the boundary surface. Two problems of computational hydrodynamics are considered to study the possibilities of the proposed difference schemes: the spatial-twodimensional flow of a viscous fluid between two coaxial semi-cylinders and the transfer of substances between coaxial semi-cylinders. Discretization of diffusion and convection operators was performed on the basis of the integro-interpolation method, taking into account taking into account the fullness of cells and without it. It is proposed to use a difference scheme, for solving the problem of diffusion – convection at large grid Peclet numbers, that takes into account the cell population function, and a scheme on the basis of linear combination of the Upwind and Standard Leapfrog difference schemes with weight coefficients obtained by minimizing the approximation error at small Courant numbers. As a reference, an analytical solution describing the Couette – Taylor flow is used to estimate the accuracy of the numerical solution. The relative error of calculations reaches 70% in the case of the direct use of rectangular grids (stepwise approximation of the boundaries), under the same conditions using the proposed method allows to reduce the error to 6%. It is shown that the fragmentation of a rectangular grid by 2–8 times in each of the spatial directions does not lead to the same increase in the accuracy that numerical solutions have, obtained taking into account the fullness of the cells. The proposed difference schemes on the basis of linear combination of the Upwind and Standard Leapfrog difference schemes with weighting factors of 2/3 and 1/3, respectively, obtained by minimizing the order of approximation error, for the diffusion – convection problem have a lower grid viscosity and, as a corollary, more precisely, describe the behavior of the solution in the case of large grid Peclet numbers.

  5. Stupitsky E.L., Andruschenko V.A.
    Physical research, numerical and analytical modeling of explosion phenomena. A review
    Computer Research and Modeling, 2020, v. 12, no. 3, pp. 505-546

    The review considers a wide range of phenomena and problems associated with the explosion. Detailed numerical studies revealed an interesting physical effect — the formation of discrete vortex structures directly behind the front of a shock wave propagating in dense layers of a heterogeneous atmosphere. The necessity of further investigation of such phenomena and the determination of the degree of their connection with the possible development of gas-dynamic instability is shown. The brief analysis of numerous works on the thermal explosion of meteoroids during their high-speed movement in the Earth’s atmosphere is given. Much attention is paid to the development of a numerical algorithm for calculating the simultaneous explosion of several fragments of meteoroids and the features of the development of such a gas-dynamic flow are analyzed. The work shows that earlier developed algorithms for calculating explosions can be successfully used to study explosive volcanic eruptions. The paper presents and discusses the results of such studies for both continental and underwater volcanoes with certain restrictions on the conditions of volcanic activity.

    The mathematical analysis is performed and the results of analytical studies of a number of important physical phenomena characteristic of explosions of high specific energy in the ionosphere are presented. It is shown that the preliminary laboratory physical modeling of the main processes that determine these phenomena is of fundamental importance for the development of sufficiently complete and adequate theoretical and numerical models of such complex phenomena as powerful plasma disturbances in the ionosphere. Laser plasma is the closest object for such a simulation. The results of the corresponding theoretical and experimental studies are presented and their scientific and practical significance is shown. The brief review of recent years on the use of laser radiation for laboratory physical modeling of the effects of a nuclear explosion on asteroid materials is given.

    As a result of the analysis performed in the review, it was possible to separate and preliminarily formulate some interesting and scientifically significant questions that must be investigated on the basis of the ideas already obtained. These are finely dispersed chemically active systems formed during the release of volcanoes; small-scale vortex structures; generation of spontaneous magnetic fields due to the development of instabilities and their role in the transformation of plasma energy during its expansion in the ionosphere. It is also important to study a possible laboratory physical simulation of the thermal explosion of bodies under the influence of highspeed plasma flow, which has only theoretical interpretations.

  6. Zatserkovnyy A.V., Nurminski E.A.
    Neural network analysis of transportation flows of urban aglomeration using the data from public video cameras
    Computer Research and Modeling, 2021, v. 13, no. 2, pp. 305-318

    Correct modeling of complex dynamics of urban transportation flows requires the collection of large volumes of empirical data to specify types of the modes and their identification. At the same time, setting a large number of observation posts is expensive and technically not always feasible. All this results in insufficient factographic support for the traffic control systems as well as for urban planners with the obvious consequences for the quality of their decisions. As one of the means to provide large-scale data collection at least for the qualitative situation analysis, the wide-area video cameras are used in different situation centers. There they are analyzed by human operators who are responsible for observation and control. Some video cameras provided their videos for common access, which makes them a valuable resource for transportation studies. However, there are significant problems with getting qualitative data from such cameras, which relate to the theory and practice of image processing. This study is devoted to the practical application of certain mainstream neuro-networking technologies for the estimation of essential characteristics of actual transportation flows. The problems arising in processing these data are analyzed, and their solutions are suggested. The convolution neural networks are used for tracking, and the methods for obtaining basic parameters of transportation flows from these observations are studied. The simplified neural networks are used for the preparation of training sets for the deep learning neural network YOLOv4 which is later used for the estimation of speed and density of automobile flows.

  7. We consider a model of spontaneous formation of a computational structure in the human brain for solving a given class of tasks in the process of performing a series of similar tasks. The model is based on a special definition of a numerical measure of the complexity of the solution algorithm. This measure has an informational property: the complexity of a computational structure consisting of two independent structures is equal to the sum of the complexities of these structures. Then the probability of spontaneous occurrence of the structure depends exponentially on the complexity of the structure. The exponential coefficient requires experimental determination for each type of problem. It may depend on the form of presentation of the source data and the procedure for issuing the result. This estimation method was applied to the results of a series of experiments that determined the strategy for solving a series of similar problems with a growing number of initial data. These experiments were described in previously published papers. Two main strategies were considered: sequential execution of the computational algorithm, or the use of parallel computing in those tasks where it is effective. These strategies differ in how calculations are performed. Using an estimate of the complexity of schemes, you can use the empirical probability of one of the strategies to calculate the probability of the other. The calculations performed showed a good match between the calculated and empirical probabilities. This confirms the hypothesis about the spontaneous formation of structures that solve the problem during the initial training of a person. The paper contains a brief description of experiments, detailed computational schemes and a strict definition of the complexity measure of computational structures and the conclusion of the dependence of the probability of structure formation on its complexity.

  8. Bozhko A.N.
    Analysis of mechanical structures of complex technical systems
    Computer Research and Modeling, 2021, v. 13, no. 5, pp. 903-916

    The work is devoted to the structural analysis of complex technical systems. Mechanical structures are considered, the properties of which affect the behavior of products during assembly, repair and operation. The main source of data on parts and mechanical connections between them is a hypergraph. This model formalizes the multidimensional basing relation. The hypergraph correctly describes the connectivity and mutual coordination of parts, which is achieved during the assembly of the product. When developing complex products in CAD systems, an engineer often makes serious design mistakes: overbasing of parts and non-sequential assembly operations. Effective ways of identifying these structural defects have been proposed. It is shown that the property of independent assembly can be represented as a closure operator whose domain is the boolean of the set of product parts. The images of this operator are connected and coordinated subsets of parts that can be assembled independently. A lattice model is described, which is the state space of the product during assembly, disassembly and decomposition into assembly units. The lattice model serves as a source of various structural information about the project. Numerical estimates of the cardinality of the set of admissible alternatives in the problems of choosing an assembly sequence and decomposition into assembly units are proposed. For many technical operations (for example, control, testing, etc.), it is necessary to mount all the operand parts in one assembly unit. A simple formalization of the technical conditions requiring the inclusion (exclusion) of parts in the assembly unit (from the assembly unit) has been developed. A theorem that gives an mathematical description of product decomposition into assembly units in exact lattice terms is given. A method for numerical evaluation of the robustness of the mechanical structure of a complex technical system is proposed.

  9. Gladin E.L., Zainullina K.E.
    Ellipsoid method for convex stochastic optimization in small dimension
    Computer Research and Modeling, 2021, v. 13, no. 6, pp. 1137-1147

    The article considers minimization of the expectation of convex function. Problems of this type often arise in machine learning and a variety of other applications. In practice, stochastic gradient descent (SGD) and similar procedures are usually used to solve such problems. We propose to use the ellipsoid method with mini-batching, which converges linearly and can be more efficient than SGD for a class of problems. This is verified by our experiments, which are publicly available. The algorithm does not require neither smoothness nor strong convexity of the objective to achieve linear convergence. Thus, its complexity does not depend on the conditional number of the problem. We prove that the method arrives at an approximate solution with given probability when using mini-batches of size proportional to the desired accuracy to the power −2. This enables efficient parallel execution of the algorithm, whereas possibilities for batch parallelization of SGD are rather limited. Despite fast convergence, ellipsoid method can result in a greater total number of calls to oracle than SGD, which works decently with small batches. Complexity is quadratic in dimension of the problem, hence the method is suitable for relatively small dimensionalities.

  10. Bazarova A.I., Beznosikov A.N., Gasnikov A.V.
    Linearly convergent gradient-free methods for minimization of parabolic approximation
    Computer Research and Modeling, 2022, v. 14, no. 2, pp. 239-255

    Finding the global minimum of a nonconvex function is one of the key and most difficult problems of the modern optimization. In this paper we consider special classes of nonconvex problems which have a clear and distinct global minimum.

    In the first part of the paper we consider two classes of «good» nonconvex functions, which can be bounded below and above by a parabolic function. This class of problems has not been widely studied in the literature, although it is rather interesting from an applied point of view. Moreover, for such problems first-order and higher-order methods may be completely ineffective in finding a global minimum. This is due to the fact that the function may oscillate heavily or may be very noisy. Therefore, our new methods use only zero-order information and are based on grid search. The size and fineness of this grid, and hence the guarantee of convergence speed and oracle complexity, depend on the «goodness» of the problem. In particular, we show that if the function is bounded by fairly close parabolic functions, then the complexity is independent of the dimension of the problem. We show that our new methods converge with a linear convergence rate $\log(1/\varepsilon)$ to a global minimum on the cube.

    In the second part of the paper, we consider the nonconvex optimization problem from a different angle. We assume that the target minimizing function is the sum of the convex quadratic problem and a nonconvex «noise» function proportional to the distance to the global solution. Considering functions with such noise assumptions for zero-order methods is new in the literature. For such a problem, we use the classical gradient-free approach with gradient approximation through finite differences. We show how the convergence analysis for our problems can be reduced to the standard analysis for convex optimization problems. In particular, we achieve a linear convergence rate for such problems as well.

    Experimental results confirm the efficiency and practical applicability of all the obtained methods.

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