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Search results for: STRUCTURAL TOPIC MODELLING
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Synthesis Attempt and Structural Studies of Novel A2CeWO6 Double Perovskites (A2+ = Ba, Ca) in and outside of Ambient Conditions
PublicationSynthesis Attempt and Structural Studies of Novel A 2 CeWO 6 Double Perovskites (A 2+ = Ba, Ca) in and outside of Ambient Conditions Damian Wlodarczyk,* Mikolaj Amilusik, Katarzyna M. Kosyl, Maciej Chrunik, Krystyna Lawniczak-Jablonska, Michal Strankowski, Marcin Zajac, Volodymyr Tsiumra, Aneta Grochot, Anna Reszka, Andrzej Suchocki, Tomasz Giela, Przemyslaw Iwanowski, Michal Bockowski, and Hanka Przybylinska Cite This: ACS Omega...
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Structural Factors Affecting Cytotoxic Activity of (E)-1-(Benzo[d ][1,3]oxathiol-6-yl)-3-phenylprop-2-en-1-one Derivatives
PublicationDerivatives of (E)-1-(5-alkoxybenzo[d][1,3]oxathiol-6-yl)-3-phenylprop-2-en-1-one (1) demonstrated exceptionally high in vitro cytotoxic activity, with IC50 values of the most active derivatives in the nanomolar range. To identify structural fragments necessary for the activity, several analogs deprived of selected fragments were prepared, and their cytotoxic activity was tested. It was found that the activity depends on combined effects...
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Nonlinear control systems modelling: global vs. local
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Using UML/WS-CDL for modelling negotiation scenarios
PublicationW celu usprawnienia realizacji przedsięwzięć ludzkich w Internecie potrzebne jest zdefiniowanie reguł i procedur komunikacji pomiędzy uczestnikami. Scenariusze przedsięwzięć mogą być wyrażane w językach opisu choreografii. Artykuł prezentuje metodologię tworzenia scenariuszy w języku WS-CDL oraz wyniki eksperymentów polegających na przeprowadzeniu negocjacji w Internecie z wykorzystaniem różnych scenariuszy negocjacyjnych.
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Modelling of acoustic heating induced by different types of sound
PublicationWyprowadzono równanie dynamiczne sterujące ogrzewaniem na skutek strat energii fali akustycznej dowolnego typu, okresowej i nieokresowej, w płynie ze standardową dyssypacją i przewodnictwem ciepła. Zbadano efektywność ogrzewania w przypadku dźwięku stochastycznego i regularnego.
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Lipid-protein interactions in membranes: a molecular modelling study
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On finite element modelling of architectural fabrics for hanging roofs
PublicationArtykuł dotyczy modelowania konstytutywnego i identyfikacji parametrów materiałowych dla tkanin technicznych powszechnie stosowanych w konstrukcjach membranowo-cięgnowych. Autorzy przedstawiają krótką charakterystyke modeli stosowanych w opisie zachowania sie tkanin technicznych. Opisano metodę do idetyfikacji nieliniowo-sprężystych właściwości tkanin technicznych. Dodatkowo dokonao porówania wyników z prób jednoosiowego rozciągania...
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Modelling of shear zones in granular materials within hypoplasticity.
PublicationW artykule przedstawiono wyniki numerycznej analizy ściskania w płaskim stanie odkształcenia dla materiałów granulowanych. Obliczenia przeprowadzono z modelem hipoplastycznym rozszerzonym o obroty, nielokalność i gradienty odkształceń.
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Możliwości modelowania w biomechanice = Modelling capabilities in biomechanics
PublicationOmówiono mozliwości modelowania w biomechanice. Zaprezentowano główne kierunki badań biomechanicznych oraz metody modelowania, w tym najbardziej popularne oprogramowania do symulacji komputerowej modeli biomechanicznych ciała człowieka. Przedstawiono metody wykorzystania programów komputerowych CHARM, SIMM oraz AnyBody System do utworzenia biomechanicznych modeli ramienia człowieka.
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Modelling of Vertical Wall Influence on the Single Bubble Motion
PublicationW referacie pokazano rezultaty badań eksperymentalnych i modelowania matematycznego siły odpychającej, działającej na model pęcherzyka przepływający wzdłuż ściany pionowej. Zaobserwowano okresowy charakter siły oraz stwierdzono, że zależy ona od liczby Reynoldsa. Porównanie obliczonych i zmierzonych wartości siły wykazało satysfakcjonującą zgodność.
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Modelling of complex economic systems : toward conceptual platform
PublicationW artykule opisano rolę modelowania opisowego w ekonomicznych systemach złożonych w kontekście trzech funkcji naukowych: opisu, wyjaśniania i przewidywania. Fazy dekompozycji i opisu jakościowego modelowanych systemów, w tym ekonomicznych, są nieodzowne w całym procesie budowania modelu.
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Machine Learning Modelling and Feature Engineering in Seismology Experiment
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Wind Turbine Operation in Electric Power System.Advanced Modelling
PublicationW monografii przedstawiono zagadnienia związane z pracą elektrowni wiatrowych w systemie elektroenergetycznym, a w tym przedstawiono wpływ elektrowni wiatrowych na system elektroenergetyczny (jakość energii elektrycznej). Omówiono zasady modelowania elektrowni wiatrowych różnych typów, tj. z generatorami asynchronicznymi i synchronicznymi, pracujących w systemie elektroenergetycznym. Przestawiono wybrane modele elektrowni wiatrowych...
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Modelling of vertical wall influence on the single bubble motion.
PublicationW referacie zaprezentowano rezultaty badań eksperymentalnych i modelowania matematycznego siły odpychającej, działającej na model pęcherzyka przepływający wzdłuż ściany pionowej. Zaobserwowano okresowy charakter tej siły oraz stwierdzono, że zależy ona od liczby Reynoldsa. Porównanie obliczonych i zmierzonych wartości siły wykazało satysfakcjonującą zgodność.
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Modelling of flow boiling process in small diameter tubes.
PublicationW pracy zastosowano standardową korelację wrzenia w przepływie (wyprowadzoną dla rur o konwencjonalnych wymiarach) do przypadków wrzenia w rurach o małych średnicach. Porównanie wyników obliczeń z danymi literaturowymi wykazało nieużyteczność tej korelacji. Wykazano zatem potrzebę prowadzenia badań podstawowych celem uzyskania korelacji pozwalającej umiejętnie przewidywać warunki wymiany ciepła w kanałach o małych średnicach.
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COMPREHENSIVE MODELLING OF THE COST EFFECTIVNESS OF RAILWAY LINE ELECTRIFICATION
PublicationSubject of this paper is the mathematical model estimating the Economical threshold between usage of combustion engine traction and electrical traction for new and modernized railway passenger communication lines. Currently available models do not coincide with the whole complexity of the problem. The proposed model was implemented into Matlab and then validated on “Pomorska Kolej Metropolitalna” investment time-frame and its cost...
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Optimization of Bread Production Using Neuro-Fuzzy Modelling
PublicationAutomation of food production is an actively researched domain. One of the areas, where automation is still not progressing significantly is bread making. The process still relies on expert knowledge regarding how to react to procedure changes depending on environmental conditions, quality of the ingredients, etc. In this paper, we propose an ANFIS-based model for changing the mixer speed during the kneading process. Although the...
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An intelligent cellular automaton scheme for modelling forest fires
PublicationForest fires have devastating consequences for the environment, the economy and human lives. Understanding their dynamics is therefore crucial for planning the resources allocated to combat them effectively. In a world where the incidence of such phenomena is increasing every year, the demand for efficient and accurate computational models is becoming increasingly necessary. In this study, we perform a revision of an initial proposal...
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Modelling the set of earthworks machinery with the use of computer simulation
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Applying Generative Modelling Tools to Explore Architectural Forms
PublicationThe digital generative methods open up new areas for exploration of formal and tectonic features, accentuate form’s ability to emerge and perform. They allow for automatic generation of variations of solutions, and digital production of “difficult” components of architectural forms using CNC technology.The paper deals with contemporary architectural explorations of complex , curvilinear surfaces in the context of generative...
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Numerical FDM modelling of wave propagation in concrete structure
PublicationThe article presents application of finite difference method to damage detection and its size evaluation in concrete structure by elastic wave propagation method. The simulations of wave propagation in concrete structure were performed for six different damage scenarios. Damages were modelled as areas with changed material properties. Investigation focused on the influence of damage size on the energy of wave reflection. Presented...
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Secondary arc modelling for single pole reclosing analyses
PublicationThe paper discusses two evaluation methods of single pole auto-reclosing process effectiveness in HV transmission lines. Secondary arc current and recovery voltage calculation results obtained by load flow calculation are compared to the results obtained by the time domain simulations. Moreover, a nonlinear secondary arc model implementation is presented. The paper presents the study results for the three types of EHV transmission...
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Mathematical Modelling and Computer Simulation of Activated Sludge Systems
PublicationPrzegląd systemów osadu czynnego. Rozwój modeli procesu osadu czynnego. Podstawowe definicje z zakresu modelowania matematycznego i symulacji komputerowej. Proces budowy modelu (model biokinetyczny, hydrodynamiczny, transferu tlenu, temperatury). Modelowanie procesów biochemicznych zachodzących w systemach osadu czynnego. Organizacja badań symulacyjnych. Praktyczne zastosowania modeli osadu czynnego.
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Propagation Path Loss Modelling in Container Terminal Environment
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Strength parameters of masonry walls in modelling historic constructions
PublicationThe paper presents the determination of the basic material properties of a historic brickwork. Experimental studies were used to identify the basic material properties of bricks. The mechanical properties of the masonry, as an orthotropic homogenized material, were calculated. Then, numerical simulations using the Finite Element Method (FEM) were performed to verify the experimental outcomes. Macromodels with element sizes of 40,...
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Hysteresis modelling of a medium frequency single-phase transformer
PublicationThe article describes a feedback Preisach hysteresis model equivalent circuit implementation of a medium frequency single-phase transformer being a part of a high power and high efficiency DC-DC converter. The macroscopic models of magnetic hysteresis are introduced and the feedback Preisach model is selected for further analysis. The hysteresis model is developed for a prototype transformer and the hysteresis loops are compared...
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Shales Leaching Modelling for Prediction of Flowback Fluid Composition
PublicationThe object of the paper is the prediction of flowback fluid composition at a laboratory scale, for which a new approach is described. The authors define leaching as a flowback fluid generation related to the shale processing. In the first step shale rock was characterized using X-ray fluorescence spectroscopy, X-ray diractometry and laboratory analysis. It was proven that shale rock samples taken from the selected sections of horizontal...
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Mechatronics design, modelling and controlling of the Stewart-Gough platform
PublicationThis paper presents a mechatronics design of a low cost Stewart-Gough platform (SGP) with rotary actuators. The designed SGP is supposed to be applied in a ball & plate control system. The synthesis of the ball & plate control system is also within the subject of the paper. A mechatronics design process of the SGP was conducted with computer-aided design (CAD) software. Unique analytical solutions of an inverse kinematics problem...
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FEM modelling of screw displacement pile interaction with subsoil
PublicationPredicting the-settlement characteristics of piles is an important element in the designing of pile foundations. The most reliable method in evaluating pile-soil interaction is the static load test, preferably performed with instrumentation for measuring shaft and pile base resistances. This, however, is a mostly post-implementation test. In the design phase, prediction methods are needed, in which numerical simulations play an...
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Modelling, thermography and digital processing of energy conversion processes
PublicationW pracy przedstawiono zagadnienia modelowania fizycznego i numerycznego procesów wymiany ciepła i konwersji energii. Do analizy wymiany ciepła w przestrzeni wypełnionej płynem zastosowano termografie krystaliczne i komputerowy system analizy otrzymanych laserowych obrazów. Wykonano również termogramy powierzchni pokrytych także ciekłokrystaliczniei jako przykład przeanalizowano rozkład temperatury na powierzchniach ciał stałych...
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Modelling of concrete behaviour in uniaxial compression and tension with DEM.
PublicationW artykule omowiono wyniki modelowania betonu podczas jednoosiowego sciskania i rozciagania stosujac metode elementów dyskretnych. Beton zostal opisany jako material 3-fazowy (kruszywo, zaprawa cementowa i strefy kontaktu). Szczegolna uwage zwrocono na zjawiska mikro-strukturalne na poziomie kruszywa (lancuchy sil, wiry, obroty ziaren). Wyniki numeryczne zostaly porownano z wynikami badan doswiadczalnych.
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Modelling of concrete using lattice and discrete element method
PublicationModelowanie betonu przy zastosowaniu metody siatkowej i metody elementów dyskretnych.
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ACI STRUCTURAL JOURNAL
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Structural and Dynamic Properties of Water within the Solvation Layer around Various Conformations of the Glycine-based Polypeptide
PublicationSeveral conformations of the solvated glycine-based polypeptides were investigated using molecular dynamics simulations. Some properties of water in the neighboring space around these molecules were investigated. It was found that water forms a well-defined layer—the first solvation shell—around the peptide molecule, and thickness of this layer is independent of the peptide structure and is equal to approximately 0.28 nm. Within...
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Processing of point cloud data retrieved from terrestrial laser scanning for structural modeling by Finite Element Method
PublicationFinite Element Method is one most popular contemporary method of strength analysis. The method is an advanced method for solving differential equations, based on discretization, which means that area is divided into finite elements. Each finite element has a solution of the equation approximated by specific functions and performing the actual calculations only for nodes of this division. Finite Element Method is widely used in...
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Structural evaluation of percolating, self-healing polyurethane–polycaprolactone blends doped with metallic, ferromagnetic, and modified graphene fillers
PublicationComposites with differently shaped micro- and nanofillers show various, unique thermal, and physicochemical properties when mixed with carefully chosen polymer matrix. Selected composition holds strategic value in achieving desired properties that is biodegradability, thermoelectric conductivity, and shape memory for organic coating. The main aim of this work is to briefly examine structural changes after reaching percolation...
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Structural evaluation of percolating, self-healing polyurethane–polycaprolactone blends doped with metallic, ferromagnetic, and modified graphene fillers
PublicationComposites with differently shaped micro- and nanofillers show various, unique thermal, and physicochemical properties when mixed with carefully chosen polymer matrix. Selected composition holds strategic value in achieving desired properties that is biodegradability, thermoelectric conductivity, and shape memory for organic coating. The main aim of this work is to briefly examine structural changes after reaching percolation threshold...
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Structural, magnetic and spectral properties of tetrahedral cobalt(II) silanethiolates: a variety of structures and manifestation of field-induced slow magnetic relaxation
PublicationBlue crystals of five heteroleptic cobalt(II) silanethiolates 1–5 have been obtained by the reaction of [Co{SSi (tBuO)3}2(NH3)]2 with aminopyridines and aminomethylpyridines at an appropriate molar ratio and their structural, spectral, thermal and magnetic properties have been established and described. All complexes 1–5 contain Co(II) ions in a tetrahedral CoN2S2 environment formed by (tBuO)3SiS− residues and pyridines and present...
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Modelowanie kratownicy z kształtowników giętych na zimno z mimośrodami dodatnimi w węźle = Modelling of truss with cold-formed section and positive eccentricyty in the node.
PublicationThe topic of this research is establishing load-carrying capacity of compressed and tensed chords of trusses made of cold-formed open cross-sections. Occurrence of bending in the truss’ chord is the result of specific production technology assumed by the designer and producer of lattice girder’s systems. The aim of this research is to present methodology of conduct while creating numerical models that best depict the behaviour...
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Integrating modelling, simulation and data management tools to create a planning support system for the improvement of air quality by urban planning solutions
PublicationThe urbanization pressure requires urban planners, designers, and policy makers to be more responsive to the challenges related to improving the quality of the urban environment and the living conditions of the inhabitants. One of the many environmental issues that need to be taken into account is urban air pollution. As the process of urban ventilation and air pollution dis-persion is significantly affected by the urban layout,...
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Central European Journal of Economic Modelling and Econometrics
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International Journal of Engineering Systems Modelling and SImulation
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International Journal of Data Mining Modelling and Management
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International Journal of Vehicle Systems Modelling and Testing
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Journal of Mathematical Modelling and Algorithms in Operations Research
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RUSSIAN JOURNAL OF NUMERICAL ANALYSIS AND MATHEMATICAL MODELLING
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Local structural and chemical ordering of nanosized Pt(3±δ)Co probed by multiple-scattering x-ray absorption spectroscopy
PublicationThis work reports a detailed investigation of the local structure and chemical disorder of a Pt(3±δ)Co thin film and Pt(3±δ)Co nanoparticles. We have used a combination of techniques including x-ray absorption spectroscopy (XAS), x-ray diffraction (XRD), and high-resolution transmission electron microscopy (TEM). The important effect of chemical ordering on pair and three-atom configurations has been studied using computer simulations...
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Structural Determinants of Substrate Specificity of SplF Protease from Staphylococcus aureus
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Elastic wave propagation in frame structure in the context of structural health monitoring
PublicationPraca dotyczy propagacji fal sprężystych r konstrukcji ramowej w ośrodku typu belka Timoszenki. Do obliczeń numerycznych wykorzystano wielowęzłowe spektralne elementy skończone klasy C0. Omówiono algorytm całkowania po czasie i sformułowano wnioski dotyczące liczby węzłów na długość fali.
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Structural Model of the Bilitranslocase Transmembrane Domain Supported by NMR and FRET Data
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