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Analysis of point model of fibrin polymerization
Computer Research and Modeling, 2017, v. 9, no. 2, pp. 247-258Views (last year): 8.Functional modeling of blood clotting and fibrin-polymer mesh formation is of a significant value for medical and biophysics applications. Despite the fact of some discrepancies present in simplified functional models their results are of the great interest for the experimental science as a handy tool of the analysis for research planning, data processing and verification. Under conditions of the good correspondence to the experiment functional models can be used as an element of the medical treatment methods and biophysical technologies. The aim of the paper in hand is a modeling of a point system of the fibrin-polymer formation as a multistage polymerization process with a sol-gel transition at the final stage. Complex-value Rosenbroke method of second order (CROS) used for computational experiments. The results of computational experiments are presented and discussed. It was shown that in the physiological range of the model coefficients there is a lag period of approximately 20 seconds between initiation of the reaction and fibrin gel appearance which fits well experimental observations of fibrin polymerization dynamics. The possibility of a number of the consequent $(n = 1–3)$ sol-gel transitions demonstrated as well. Such a specific behavior is a consequence of multistage nature of fibrin polymerization process. At the final stage the solution of fibrin oligomers of length 10 can reach a semidilute state, leading to an extremely fast gel formation controlled by oligomers’ rotational diffusion. Otherwise, if the semidilute state is not reached the gel formation is controlled by significantly slower process of translational diffusion. Such a duality in the sol-gel transition led authors to necessity of introduction of a switch-function in an equation for fibrin-polymer formation kinetics. Consequent polymerization events can correspond to experimental systems where fibrin mesh formed gets withdrawn from the volume by some physical process like precipitation. The sensitivity analysis of presented system shows that dependence on the first stage polymerization reaction constant is non-trivial.
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Machine learning interpretation of inter-well radiowave survey data
Computer Research and Modeling, 2019, v. 11, no. 4, pp. 675-684Views (last year): 3.Traditional geological search methods going to be ineffective. The exploration depth of kimberlite bodies and ore deposits has increased significantly. The only direct exploration method is to drill a system of wells to the depths that provide access to the enclosing rocks. Due to the high cost of drilling, the role of inter-well survey methods has increased. They allows to increase the mean well spacing without significantly reducing the kimberlite or ore body missing probability. The method of inter-well radio wave survey is effective to search for high contrast conductivity objects. The physics of the method based on the dependence of the electromagnetic wave propagation on the propagation medium conductivity. The source and receiver of electromagnetic radiation is an electric dipole, they are placed in adjacent wells. The distance between the source and receiver is known. Therefore we could estimate the medium absorption coefficient by the rate of radio wave amplitude decrease. Low electrical resistance rocks corresponds to high absorption of radio waves. The inter-well measurement data allows to estimate an effective electrical resistance (or conductivity) of the rock. Typically, the source and receiver are immersed in adjacent wells synchronously. The value of the of the electric field amplitude measured at the receiver site allows to estimate the average value of the attenuation coefficient on the line connecting the source and receiver. The measurements are taken during stops, approximately every 5 m. The distance between stops is much less than the distance between adjacent wells. This leads to significant spatial anisotropy in the measured data distribution. Drill grid covers a large area, and our point is to build a three-dimensional model of the distribution of the electrical properties of the inter-well space throughout the whole area. The anisotropy of spatial distribution makes hard to the use of standard geostatistics approach. To build a three-dimensional model of attenuation coefficient, we used one of machine learning theory methods, the method of nearest neighbors. In this method, the value of the absorption coefficient at a given point is calculated by $k$ nearest measurements. The number $k$ should be determined from additional reasons. The spatial distribution anisotropy effect can be reduced by changing the spatial scale in the horizontal direction. The scale factor $\lambda$ is one yet external parameter of the problem. To select the parameters $k$ and $\lambda$ values we used the determination coefficient. To demonstrate the absorption coefficient three-dimensional image construction we apply the procedure to the inter-well radio wave survey data. The data was obtained at one of the sites in Yakutia.
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Synchronization of the asymmetrical system with three non-identical Kuramoto oscillators: models of solar meridional circulation
Computer Research and Modeling, 2020, v. 12, no. 2, pp. 345-356Kuramoto model of non-linearly coupled oscillators provides a simple but effective approach to the study of the synchronization phenomenon in complex systems. In the present article we consider a particular Kuramoto model with three non-identical oscillators associated with a multi-cell radial profile of the solar meridional circulation. The top and the bottom oscillators are coupled through the middle one. The main difference of the present Kuramoto model from the previous ones consists in the non-identical coupling: coupling coefficients which tie the middle oscillator with the top and the bottom ones are different. We investigate how the value of the coupling asymmetry of the middle oscillator influences the synchronization. In the present model the synchronization conditions appear to be different the classical Kuramoto model allowing the synchronization to be reached with weaker coupling. We perform a reconstruction of coupling coefficients from the phase difference between the top and the bottom oscillators, assuming that the synchronization is reached and the natural frequencies are known. The absolute cumulative coupling is uniquely determined by the phase difference between the top and the bottom oscillators and the coupling asymmetry of the middle oscillator. In general case, higher values of the coupling asymmetry of the middle oscillator correspond to lower cumulative coupling. A unique coupling reconstruction with unknown coupling asymmetry is possible in general case only for the weak cumulative coupling. Deviations from the general case are discussed. We perform a model simulation with natural frequencies estimated from the velocities of the solar meridional flow. Heliseismological observations of the deep flow may be attributed either to the middle cell or to the deep one. We discuss the difference between these two cases in terms of the coupling reconstruction.
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Distributed computing model for the organization of a software environment that provides management of intelligent building automation systems
Computer Research and Modeling, 2021, v. 13, no. 3, pp. 557-570The present article describes the authors’ model of construction of the distributed computer network and realization in it of the distributed calculations which are carried out within the limits of the software-information environment providing management of the information, automated and engineering systems of intellectual buildings. The presented model is based on the functional approach with encapsulation of the non-determined calculations and various side effects in monadic calculations that allows to apply all advantages of functional programming to a choice and execution of scenarios of management of various aspects of life activity of buildings and constructions. Besides, the described model can be used together with process of intellectualization of technical and sociotechnical systems for increase of level of independence of decision-making on management of values of parameters of the internal environment of a building, and also for realization of methods of adaptive management, in particular application of various techniques and approaches of an artificial intellect. An important part of the model is a directed acyclic graph, which is an extension of the blockchain with the ability to categorically reduce the cost of transactions taking into account the execution of smart contracts. According to the authors it will allow one to realize new technologies and methods — the distributed register on the basis of the directed acyclic graph, calculation on edge and the hybrid scheme of construction of artificial intellectual systems — and all this together can be used for increase of efficiency of management of intellectual buildings. Actuality of the presented model is based on necessity and importance of translation of processes of management of life cycle of buildings and constructions in paradigm of Industry 4.0 and application for management of methods of an artificial intellect with universal introduction of independent artificial cognitive agents. Model novelty follows from cumulative consideration of the distributed calculations within the limits of the functional approach and hybrid paradigm of construction of artificial intellectual agents for management of intellectual buildings. The work is theoretical. The article will be interesting to scientists and engineers working in the field of automation of technological and industrial processes both within the limits of intellectual buildings, and concerning management of complex technical and social and technical systems as a whole.
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Modeling the dynamics of plankton community considering phytoplankton toxicity
Computer Research and Modeling, 2022, v. 14, no. 6, pp. 1301-1323We propose a three-component discrete-time model of the phytoplankton-zooplankton community, in which toxic and non-toxic species of phytoplankton compete for resources. The use of the Holling functional response of type II allows us to describe an interaction between zooplankton and phytoplankton. With the Ricker competition model, we describe the restriction of phytoplankton biomass growth by the availability of external resources (mineral nutrition, oxygen, light, etc.). Many phytoplankton species, including diatom algae, are known not to release toxins if they are not damaged. Zooplankton pressure on phytoplankton decreases in the presence of toxic substances. For example, Copepods are selective in their food choices and avoid consuming toxin-producing phytoplankton. Therefore, in our model, zooplankton (predator) consumes only non-toxic phytoplankton species being prey, and toxic species phytoplankton only competes with non-toxic for resources.
We study analytically and numerically the proposed model. Dynamic mode maps allow us to investigate stability domains of fixed points, bifurcations, and the evolution of the community. Stability loss of fixed points is shown to occur only through a cascade of period-doubling bifurcations. The Neimark – Sacker scenario leading to the appearance of quasiperiodic oscillations is found to realize as well. Changes in intrapopulation parameters of phytoplankton or zooplankton can lead to abrupt transitions from regular to quasi-periodic dynamics (according to the Neimark – Sacker scenario) and further to cycles with a short period or even stationary dynamics. In the multistability areas, an initial condition variation with the unchanged values of all model parameters can shift the current dynamic mode or/and community composition.
The proposed discrete-time model of community is quite simple and reveals dynamics of interacting species that coincide with features of experimental dynamics. In particular, the system shows behavior like in prey-predator models without evolution: the predator fluctuations lag behind those of prey by about a quarter of the period. Considering the phytoplankton genetic heterogeneity, in the simplest case of two genetically different forms: toxic and non-toxic ones, allows the model to demonstrate both long-period antiphase oscillations of predator and prey and cryptic cycles. During the cryptic cycle, the prey density remains almost constant with fluctuating predators, which corresponds to the influence of rapid evolution masking the trophic interaction.
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On the kinetics of entropy of a system with discrete microscopic states
Computer Research and Modeling, 2023, v. 15, no. 5, pp. 1207-1236An isolated system, which possesses a discrete set of microscopic states, is considered. The system performs spontaneous random transitions between the microstates. Kinetic equations for the probabilities of the system staying in various microstates are formulated. A general dimensionless expression for entropy of such a system, which depends on the probability distribution, is considered. Two problems are stated: 1) to study the effect of possible unequal probabilities of different microstates, in particular, when the system is in its internal equilibrium, on the system entropy value, and 2) to study the kinetics of microstate probability distribution and entropy evolution of the system in nonequilibrium states. The kinetics for the rates of transitions between the microstates is assumed to be first-order. Two variants of the effects of possible nonequiprobability of the microstates are considered: i) the microstates form two subgroups the probabilities of which are similar within each subgroup but differ between the subgroups, and ii) the microstate probabilities vary arbitrarily around the point at which they are all equal. It is found that, under a fixed total number of microstates, the deviations of entropy from the value corresponding to the equiprobable microstate distribution are extremely small. The latter is a rigorous substantiation of the known hypothesis about the equiprobability of microstates under the thermodynamic equilibrium. On the other hand, based on several characteristic examples, it is shown that the structure of random transitions between the microstates exerts a considerable effect on the rate and mode of the establishment of the system internal equilibrium, on entropy time dependence and expression of the entropy production rate. Under definite schemes of these transitions, there are possibilities of fast and slow components in the transients and of the existence of transients in the form of damped oscillations. The condition of universality and stability of equilibrium microstate distribution is that for any pair of microstates, a sequence of transitions should exist, which provides the passage from one microstate to next, and, consequently, any microstate traps should be absent.
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Permeability of lipid membranes. A molecular dynamic study
Computer Research and Modeling, 2009, v. 1, no. 4, pp. 423-436Views (last year): 20. Citations: 2 (RSCI).A correct model of lipid molecule (distearoylphosphatidylcholine, DSPC) and lipid membrane in water was constructed. Model lipid membrane is stable and has a reliable energy distribution among degrees of freedom. Also after equilibration model system has spatial parameters very similar to those of real DSPC membrane in liquid-crystalline phase. This model was used for studying of lipid membrane permeability to oxygen and water molecules and sodium ion. We obtained the values for transmembrane mobility and diffusion coefficients profiles, which we used for effective permeability coefficients calculation. We found lipid membranes to have significant diffusional resistance to penetration not only by charged particles, such as ions, but also by nonpolar molecules, such as oxygen molecule. We propose theoretical approach for calculation of particle flow across a membrane, as well as methods for estimation of distribution coefficients between bilayer and water phase.
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A new biometric approach and efficient system for automatic detection and analysis of digital retinal images
Computer Research and Modeling, 2010, v. 2, no. 2, pp. 189-197Views (last year): 3.The program for automatic revealing of threshold values for characterizing physiological state of vessels and detection of early stages of retina pathology is offered. The algorithm is based on checking character of crossing sites of vessel images with the "mask" consisting of concentric circumferences (the first circumference is imposed directly on the sclera capsules of an optic nerve disk). The new method allows revealing of a network of blood vessels and flanking zones and detection of initial stage of pathological changes in a retina by digital images.
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Mathematical modeling of neutron transfers in nuclear reactions considering spin-orbit interaction
Computer Research and Modeling, 2010, v. 2, no. 4, pp. 393-401Views (last year): 4.The difference scheme for numerical solution of a time-dependant system of two Schrödinger equations with the operator of a spin-orbit interaction for a two-component spinor wave function is offered on the basis of a split method for a time-dependant Schrödinger equations. The computer simulation of the external neutrons’ wave functions evolution with different values of the full moment projection upon internuclear axis and probabilities of their transfer are executed for head-on collisions of 18O and 58Ni nuclei.
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Computer analysis of the bone regeneration strength in a model system of osteosynthesis by the Ilizarov fixator with static loads
Computer Research and Modeling, 2014, v. 6, no. 3, pp. 427-440Views (last year): 3.The adequate complexity three-dimensional finite element model of biomechanical system with space, shell and beam-type elements was built. The model includes the Ilizarov fixator and tibial bone’s simulator with the regenerating tissue at the fracture location. The proposed model allows us to specify the orthotropic elastic properties of tibial bone model in cortical and trabecular zones. It is also possible to change the basic geometrical and mechanical characteristics of biomechanical system, change the finite element mash density and define the different external loads, such as pressure on the bone and compression or distraction between the repositioned rings of Ilizarov device.
By using special APDL ANSYS program macros the mode of deformation was calculated in the fracture zone for various static loads on the simulator bone, for compression or distraction between the repositioned rings and for various mechanical properties during different stages of the bone regenerate formation (gelatinous, cartilaginous, trabecular and cortical bone remodeling). The obtained results allow us to estimate the permissible values of the external pressure on the bone and of the displacements of the Ilizarov fixator rings for different stages of the bone regeneration, based on the admittance criterion for the maximum of the stresses in the callus. The presented data can be used in a clinical condition for planning, realization and monitoring of the power modes for transosseous osteosynthesis with the external Ilizarov fixator.
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