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Search results for: COMPUTATIONAL FLUID DYNAMICS
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Analysis of observability and detectability for CSTR model of biochemical processes under uncertain system dynamics and various sets of measured outputs
PublicationAn analysis of observability and detectability for continuous stirred tank reactor model of selected biochemical processes has been addressed in this paper. In particular, properties of observability or detectability of the considered system model have been proved under uncertain system dynamics in view of various sets of system measured outputs. It is related to considering system dynamics depending on initial conditions and the...
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Unique agreement of experimental and computational infrared spectroscopy: a case study of lithium bromide solvation in an important electrochemical solvent
PublicationInfrared (IR) spectroscopy is a widely used and invaluable tool in the studies of solvation phenomena in electrolyte solutions. Using state-of-the-art chemometric analysis of a spectral series measured in a concentration-dependent manner, the spectrum of the solute-affected solvent can be extracted, providing a detailed view of the structural and energetic states of the solvent molecules influenced by the solute. Concurrently,...
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The dynamics of the total output of the Japanese fisheries sector: An analysis using input-output approach
PublicationThe purpose of this study is to investigate the dynamics of the total output of the fisheries industry when the changes of the final demand occur. This study focuses on the case of Japan. This study employs a demand-pull Input-Output (IO) quantity model, one of the calculation instruments in the IO analysis, as an analysis tool. Two conditions are included in calculation and analysis parts, namely (1) “whole sector change”, and...
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Using a computational model to compare objective negotiations in real and virtual environments
PublicationZaprezentowano obliczeniowy model negocjacji uwzględniający warunki początkowe, przebieg negocjacji i wyniki negocjacji. Przedstawiono komputerowy system wspomagający rejestrację przebiegu negocjacji i ich wyników oraz analizę negocjacji zgodną z proponowanym modelem.
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Computational issues of solving the 1D steady gradually varied flow equation
PublicationIn this paper a problem of multiple solutions of steady gradually varied flow equation in the form of the ordinary differential energy equation is discussed from the viewpoint of its numerical solution. Using the Lipschitz theorem dealing with the uniqueness of solution of an initial value problem for the ordinary differential equation it was shown that the steady gradually varied flow equation can have more than one solution....
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Computational Selectivity Assessment of Protease Inhibitors against SARS-CoV-2
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Contact with coupled adhesion and friction: Computational framework, applications, and new insights
PublicationContact involving soft materials often combines dry adhesion, sliding friction, and large deformations. At the local level, these three aspects are rarely captured simultaneously, but included in the theoretical models by Mergel et al., (2019). We here develop a corresponding finite element framework that captures 3D finite-strain contact of two deformable bodies. This framework is suitable to investigate sliding friction even...
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Experimental and computational study on mechanical behaviour of carpentry corner log joints
PublicationThis work concerns experimental and numerical research on carpentry joints used in historic wooden buildings in southeastern Poland and western Ukraine. These structures are mainly sacred buildings, and the types of corner log joints characteristic of this region are primarily saddle-notch and dovetail joints; thus, these two types of joints were analysed in this study. The modelling of historic timber structures is a complex...
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A Computational Analysis of the Proton Affinity and the Hydration of TEMPO and Its Piperidine Analogs
PublicationThe study investigated the impact of protonation and hydration on the geometry of nitroxide radicals using B3LYP and M06-2X methods. Results indicated that TEMPO exhibited the highest proton affinity in comparison to TEMPOL and TEMPONE. Two pathways contribute to hydrated protonated molecules. TEMPO shows lower first enthalpies of hydration (ΔH1-M), indicating stronger H-bonding interactions, while TEMPONE shows higher values,...
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Computational analysis of an infinite magneto-thermoelastic solid periodically dispersed with varying heat flow based on non-local Moore–Gibson–Thompson approach
PublicationIn this investigation, a computational analysis is conducted to study a magneto-thermoelastic problem for an isotropic perfectly conducting half-space medium. The medium is subjected to a periodic heat flow in the presence of a continuous longitude magnetic field. Based on Moore–Gibson–Thompson equation, a new generalized model has been investigated to address the considered problem. The introduced model can be formulated by combining...
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Thermo-fluid Transport Phenomena in Air-fed Pressurised Protective Clothing
PublicationPublikacja opisuje sposób modelowania turbulentnych przepływów dwuskładnikowych w ciśnieniowych kombinezonach ochronnych, które używane są w reaktorach fuzyjnych. Rozważane są różne modele turbulencji. Przepływy modelowane są w realistycznych geometriach, które odtwarzane są metodą fotogrametrii. Pokazano również sposób modelowania kondensacji pary wodnej na wewnętrznych powierzchniach kombinezonów.
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FURTHER REMARKS ON THE SURFACE VIS IMPRESSA CAUSED BY A FLUID-SOLID CONTACT
PublicationIt is well-known that, nano-mechanics should take into account not only physical phenomena occuring within the bulk but, first of all, the physical phenomena appropriate for a surface of two materials contact. The huge volume density of internal surfaces as well countours lines located within the nanomaterial results in our interest in, apart from classical form of mass, momentum and entropy transport, those modes of transportation...
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Supercritical fluid extraction as a tool to valorize underexploited freshwater green algae
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Modelling and testing of a hydrodynamic clutch filled with electrorheological fluid in varying degree
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High Concentrations of Excised Oxidative DNA Lesions in Human Cerebrospinal Fluid
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Application of the fluid–structure interaction technique for the analysis of hydrodynamic lubrication problems
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Heat transfer and fluid flow visualization using liquid crystal thermography
PublicationW pracy przedstawiono możliwości wykrzystania termografii ciekłokrystalicznej do badań wymiany ciepła oraz wizualizacji pola przepływu w elementach urządzeń przemysłowych.
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The use of liquid crystal thermography for heat, fluid flow and biomedical research.
PublicationW ostatniej dekadzie termografia ciekłokrystaliczna (TLC) i cyfrowa analiza kolorowych obrazów była z powodzeniem stosowana w różnych aplikacjach technicznych, przemysłowych i biomedycznych. Cienkie warstwy ciekłokrystaliczne zastosowano dla uzyskania lokalnych pól temperatury, współczynników przekazywania ciepła i określenia rodzaju procesu. Materiał ciekłokrystaliczny można również zastosować do wizualizacji pól temperatury i...
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Influence of Bingham fluid viscosity on energy performances of a vortex chamber pump
PublicationOne of the problems in the development of coal-water technologies is the use of reliable and long-lasting pumps. To date, classic pumps, due to the use of mechanical moving parts and seals, are subject to rapid abrasive wear. The solution to this problem can lie in the creation of new vortex chamber pumps developed by the authors. They are highly reliable, simple in design and have no moving parts. The object of this paper consists...
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Volume efficiency loss in axial pumps caused by working fluid compressibility.
PublicationPrzedstawiono teoretyczną analizę wpływu ściśliwości cieczy roboczej konstrukcji mechanizmu rozrządu pompy wielotłoczkowej osiowej na straty energetyczne w przestrzeni martwej. Podano wyniki uzyskane dla typowych konstrukcji.
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The ring propeller with conical electromagnetic bearings and magneto fluid sealing system.
PublicationW przedstawionej koncepcji nowego zespołu napędowego najbardziej znamiennym rozwiązaniem jest zastosowanie nowoczesnych łożysk elektromagnetycznych dla pędnika śrubowego w prototypowej wersji silnika pierścieniowego synchronicznego z magnesami z ziem rzadkich. W artykule przedstawiono konstrukcję stożkowych łożysk magnetycznych. Technika uszczelniania cieczami magnetycznymi jest nową koncepcją pozwalającą na rozwiązywanie wielu...
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Modeling of capillary fluid flow in concrete using a DEM-CFD approach
PublicationSformułowano połączone podejście do modelowania dwufazowego przepływu wody napędzanego hydraulicznie i kapilarnie w nienasyconym betonie. Proces przepływu analizowano numerycznie w mezoskali w warunkach dwuwymiarowych (2D), łącząc metodę elementów dyskretnych (DEM) z obliczeniową dynamiką płynów (CFD) w warunkach izotermicznych. Przeprowadzono w pełni sprzężone hydromechaniczne testy symulacyjne na małych próbkach betonu o uproszczonej...
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Independent dynamics of slow, intermediate, and fast intracranial EEG spectral activities during human memory formation
PublicationA wide spectrum of brain rhythms are engaged throughout the human cortex in cognitive functions. How the rhythms of various low and high frequencies are spatiotemporally coordinated across the human brain during memory processing is inconclusive. They can either be coordinated together across a wide range of the frequency spectrum or induced in specific bands. We used a large dataset of human intracranial electroencephalography...
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Molecular Dynamics to Predict Cryo-EM: Capturing Transitions and Short-Lived Conformational States of Biomolecules
PublicationSingle-particle cryogenic electron microscopy (cryo-EM) has revolutionized the field of the structural biology, providing an access to the atomic resolution structures of large biomolecular complexes in their near-native environment. Today’s cryo-EM maps can frequently reach the atomic-level resolution, while often containing a range of resolutions, with conformationally variable regions obtained at 6 Å or worse. Low resolution...
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Entropic Measures of Complexity of Short-Term Dynamics of Nocturnal Heartbeats in an Aging Population
PublicationTwo entropy-based approaches are investigated to study patterns describing differences in time intervals between consecutive heartbeats. The first method explores matrices arising from networks of transitions constructed following events represented by a time series. The second method considers distributions of ordinal patterns of length three, whereby patterns with repeated values are counted as different patterns. Both methods provide...
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Model Management for Low-Computational-Budget Simulation-Based Optimization of Antenna Structures Using Nature-Inspired Algorithms
PublicationThe primary objective of this study is investigation of the possibilities of accelerating nature-inspired optimization of antenna structures using multi-fidelity EM simulation models. The primary methodology developed to achieve acceleration is a model management scheme which the level of EM simulation fidelity using two criteria: the convergence status of the optimization algorithm, and relative quality of the individual designs...
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International Journal of Fluid Mechanics Research
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International Journal of Fluid Machinery and Systems
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INTERNATIONAL JOURNAL OF HEAT AND FLUID FLOW
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JOURNAL OF NON-NEWTONIAN FLUID MECHANICS
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Mechanism of recognition of parallel G-quadruplexes by DEAH/RHAU helicase DHX36 explored by molecular dynamics simulations
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Unusual dynamics and nonlinear thermal self-focusing of initially focused magnetoacoustic beams in a plasma
PublicationUnusual thermal self-focusing of two-dimensional beams in plasma which axis is parallel to the equilibrium straight magnetic field is considered. The equi- librium parameters of plasma determine scenario of a beam divergence (usual or unusual) which is stronger as compared with a flow without magnetic field. Nonlinear thermal self-action of a magnetosonic beam behaves differently in the ordinary and unusual cases. Damping of wave...
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Reservoir Influence on Pressure Wave Propagation in Steel Pipes
PublicationThe relation between the length of steel pipe and the pressure wave period in the system, reservoir-pipe-valve, is discussed. Experiments carried out for the short steel pipes showed that in such a system, the pressure wave celerity estimated using the measured wave cycles systematically increases with the increase of the pipe length. The observed differences can exceed even 90 m=s. As the pressure wave traveling in the pipe with...
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Effect of annealing temperature on slurry erosion resistance of ferritic X10CrAlSi18 steel
PublicationIn the present work, the slurry erosion tests were carried out to investigate the influence of heat treatment on slurry erosion process of ferritic X10CrAlSi18 stainless steel using a slurry pot test rig. X10CrAlSi18 stainless steel was tested in as-received condition and after annealing at three different temperatures: 600°C, 800°C and 1000°C. Degradation of materials due to slurry erosion depends on many factors connected with...
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Coupling between Blood Pressure and Subarachnoid Space Width Oscillations during Slow Breathing
PublicationThe precise mechanisms connecting the cardiovascular system and the cerebrospinal fluid (CSF) are not well understood in detail. This paper investigates the couplings between the cardiac and respiratory components, as extracted from blood pressure (BP) signals and oscillations of the subarachnoid space width (SAS), collected during slow ventilation and ventilation against inspiration resistance. The experiment was performed on...
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Diagnostic Accuracy of Liquid Biopsy in Endometrial Cancer
PublicationBackground: Liquid biopsy is a minimally invasive collection of a patient body fluid sample. In oncology, they offer several advantages compared to traditional tissue biopsies. However, the potential of this method in endometrial cancer (EC) remains poorly explored. We studied the utility of tumor educated platelets (TEPs) and circulating tumor DNA (ctDNA) for preoperative EC diagnosis, including histology determination. Methods:...
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Extended micropolar approach within the framework of 3M theories and variations thereof
PublicationAs part of his groundbreaking work on generalized continuum mechanics, Eringen proposed what he called 3M theories, namely the concept of micromorphic, microstretch, and micropolar materials modeling. The micromorphic approach provides the most general framework for a continuum with translational and (internal) rotational degrees of freedom (DOF), whilst the rotational DOFs of micromorphic and micropolar continua are subjected...
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The protocol for using elastic wall model in modeling blood flow within human artery
PublicationMedical diagnostic tools will play a major role in the future for an effective patient treatment and reduction their mortality, related to the cardiovascular system diseases (CVDs). There is an urgent need for developing diagnostic procedure to be robust, reliable, accurate and efficient, in the framework of a paradigm shift. Application of numerical techniques is seen as a perspective tool for such purpose. Nevertheless, existing...
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Ahmer Bin Hafeez
PeopleI have experience in Microbiology & Computational Biology, particularly bioinformatics, homology modeling, phylogenetics, structural biology, and drug discovery. Currently, my interest lies in translatable omics studies and drug discovery against novel protein targets involved in cancer and infectious diseases and Host-Pathogen PPIs. My aim involves the use of computational methods for the identification of novel targets and to...
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Catalytic Mechanism of Non-Target DNA Cleavage in CRISPR-Cas9 Revealed by Ab Initio Molecular Dynamics
PublicationCRISPR-Cas9 is a cutting-edge genome editing technology, which uses the endonuclease Cas9 to introduce mutations at desired sites of the genome. This revolutionary tool is promising to treat a myriad of human genetic diseases. Nevertheless, the molecular basis of DNA cleavage, which is a fundamental step for genome editing, has not been established. Here, quantum–classical molecular dynamics (MD) and free energy methods are used...
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Dariusz Mikielewicz prof. dr hab. inż.
PeopleProfessor Dariusz Mikielewicz – born on February 6, 1967. in Gdansk. Here in 1974 he enrolled first to the Elementary School No. 17, and then in the Grammar School No. 5, named after Stefan Żeromski in Gdansk-Oliwa. After graduating from the Secondary School, with honors, in 1985 he successfully passed the entrance exams to the Faculty of Mechanical Engineering of Technical University of Gdansk, where he graduated with a very good...
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Free volume in physical absorption of carbon dioxide in ionic liquids: Molecular dynamics supported modeling
PublicationUnderstanding the mechanisms underlying the carbon dioxide (CO2) absorption in ionic liquids (ILs) is the key to their efficient utilization in industrial flue gas treatment. One of the parameters considered substantially important in the process is the Free Volume. In this study, the Fractional Free Volume (FFV) of 73 ILs was calculated using Molecular Dynamics (MD). A quantitative Structure-Property Relationship (QSPR) study...
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Dynamics of the circular sawing machine spindle system
PublicationW pracy przedstawiono wyniki badań wpływu prędkości obrotowej na dynamikę układu wrzecionowego pilarki tarczowej. Czynnikami badanymi były bicie osiowe i promieniowe wrzeciona, które mierzono za pomocą czujników wiroprądowych na kierunku działania przekładni pasowej, a także na kierunku do niego prostopadłym. Przeprowadzone badania eksperymentalne wykazały, że wartość prędkości obrotowej wrzeciona oraz sposób przekazywania mocy...
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Dynamics of the total system of the circular sawing machine
PublicationW pracy przedstwaiono przyczyny i efekty zmiany położenia ostrzy piły tarczowej. Opisana metoda pomiaru zachowania dynamicznego piły pozwala uzytkownikowi okreslic przyczyny drgań. Ponadto, może wskazać drogi efektywnej ich minimalizacji.
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User authentication based on keystroke dynamics analysis
PublicationW pracy przedstawiono kilka metod, które można wykorzystać do uwierzytelniania użytkowników na podstawie rytmu pisania na klawiaturze. Dwie z opisanych metod wykorzystują miarę odległości zdefiniowaną do porównywania wpisywanych tekstów, natomiast trzecia analizuje parametry rozkładów cech wydobytych z wpisywanych tekstów. Algorytmy te zostały przetestowane na dwóch zbiorach danych. Ponadto oceniona została efektywność metody powstałej...
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Stochastic approach to the dynamics of marine floating object
PublicationAnalizowany jest ruch jednostki pływającej z uwzględnieniem w równaniach stochastycznych nieliniowości, występującej w wymuszeniach zewnętrznych działających na obiekt. Stochastyczne równania różniczkowe są zapisane dla sprzężonych ruchów symetrycznych.
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Billiard in a rotating half-plane: modeling and dynamics
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Circular saw blade dynamics - the measurement method
PublicationW pracy przedstawiono przyczyny i efekty zmiany położenia ostrzy piły tarczowej w układzie przecinania. Przedstawiony sposób pomiaru dynamiki piły tarczowej umożliwia określenie przyczyn drgań, co stanowi podstawę skutecznej ich minimalizacji.
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Thin-walled frames and grids - statics and dynamics
PublicationFrames and grids assembled with thin-walled beams of open cross-section are widely applied in various civil engineering and vehicle or machine structures. Static and dynamic analysis of theses structures may be carried out by means of different models, startingfrom the classical models made of beam elements undergoing the Kirchhoff assumptions to the FE discretization of whole frame into plane elements. The former model is very...
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Influence of IED Explosion on Lateral Dynamics of a Vehicle
PublicationThe paper describes field test results of heavy vehicle tire blow-outs. Both civilian and military vehicles are subjected to sudden loss of inflation pressure in one or more wheels, often accompanied by serious tire damage. Selected results related to the lateral dynamic of vehicle during and just after explosive tire destruction are reported