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Wyniki wyszukiwania dla: DENSITY FUNCTIONAL THEORY
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Synthesis and polymerisation techniques of molecularly imprinted polymers
PublikacjaMolecularly Imprinted Polymers (MIPs) are materials that has been processed using the molecular imprinting technique which permit to obtain well-defined three-dimensional cavities, with affinity to a template molecule, in the polymer matrix. Technology involves three strategies, i.e., covalent, non-covalent and semi-covalent approach, but the most popular is non-covalent approach. The most important components for the synthesis...
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The occurrence and role of Nitrospira in nitrogen removal systems
PublikacjaApplication of the modern microbial techniques changed the paradigm about the microorganisms performing nitrification. Numerous investigations recognized representatives of the genus Nitrospira as a key and predominant nitrite-oxidizing bacteria in biological nutrient removal systems, especially under low dissolved oxygen and substrate conditions. The recent discovery of Nitrospira capable of performing complete ammonia oxidation...
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Recent progress in the development of steroid sulfatase inhibitors – examples of the novel and most promising compounds from the last decade
PublikacjaThe purpose of this review article is to provide an overview of recent achievements in the synthesis of novel steroid sulfatase (STS) inhibitors. STS is a crucial enzyme in the biosynthesis of active hormones (including estrogens and androgens) and, therefore, represents an extremely attractive molecular target for the development of hormone-dependent cancer therapies. The inhibition of STS may effectively reduce the availability...
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Design of dimensionally stable composites using efficient global optimization method
PublikacjaDimensionally stable material design is an important issue for space structures such as space laser communication systems, telescopes, and satellites. Suitably designed composite materials for this purpose can meet the functional and structural requirements. In this paper, it is aimed to design the dimensionally stable laminated composites by using efficient global optimization method. For this purpose, the composite plate optimization...
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Rapid design closure of microwave components by means of feature-based optimization and adjoint sensitivities
PublikacjaIn this article, fast design closure of microwave components using feature-based optimization (FBO) and adjoint sensitivities is discussed. FBO is one of the most recent optimization techniques that exploits a particular structure of the system response to “flatten” the functional landscape handled during the optimization process, which leads to reducing its computational complexity. When combined with gradient-based search involving...
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Footbridges. Dynamic Design – Selected Problems
PublikacjaModern footbridges create challenge in esthetic and structural design. Breaking the proven canons is a recipe for architectural success. However esthetic form has to be also a functional pedestrian bridge. Therefore a good FEM modeling is a key element in engineering part of design. The paper presents selected problems related to the modeling of the dynamic construction of footbridges. Several basic dynamic problems concerning...
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Design of residential buildings in architecture education
PublikacjaThis article is based on an analysis of residential building designs made by students of the Faculty of Architecture at Gdańsk University of Technology (FA-GUT), Poland, and on the results of a survey conducted among these students. The purpose of the survey was to verify the broad, interdisciplinary knowledge of the students required in preparation for taking up design issues, as well as their ability to use this knowledge in...
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Multi-state multi-reference Møller-Plesset second-order perturbation theory for molecular calculations
PublikacjaThis work presents multi‐state multi‐reference Møller–Plesset second‐order perturbation theory as a variant of multi‐reference perturbation theory to treat electron correlation in molecules. An effective Hamiltonian is constructed from the first‐order wave operator to treat several strongly interacting electronic states simultaneously. The wave operator is obtained by solving the generalized Bloch equation within the first‐order...
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MSIS sonar image segmentation method based on underwater viewshed analysis and high-density seabed model
PublikacjaHigh resolution images of Mechanically Scanned Imaging Sonars can bring detailed representation of underwater area if favorable conditions for acoustic signal to propagate are provided. However to properly asses underwater situation based solely on such data can be challenging for less than proficient interpreter. In this paper we propose a method to enhance interpretative potential of MSIS image by dividing it in to subareas depending...
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Analytical Buckling of FG Nanobeams on The Basis of A New One Variable First-Order Shear Deformation Beam Theory
PublikacjaIn this work, buckling analysis of functionally graded (FG) nanobeams based on a new refined beam theory has been analyzed. The beam is modeled as an elastic beam subjected to unidirectional compressive loads. To achieve this aim, the new obtained beam theory has only one variable which lead to one equation similar to Euler beam theory and also is free of any shear correction factor. The...
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Approximate methods for functional differential equations
PublikacjaW pracy przedstawione są dwie klasy przybliżonych metod rozwiązywania równań różniczkowo funkcyjnych ze szczególnym uwzględnieniem równań różniczkowych z opóźnieniem. Do pierwszej klasy należą metody bezpośrednie reprezentowane w przedkładanej rozprawie przez dwukrokowe metody Rungego-Kutty. Należą one do klasy ogólnych metod liniowych rozwiązywania równań różniczkowych. Druga klasę przybliżonych metod rozwiązywania równań różniczkowo...
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Implicit difference functional inequalities and applications
PublikacjaKlasyczne rozwiązania problemów początkowych przybliżane są rozwiązaniami uwikłanych metod różnicowych. Wykazana została zbieżność i stabilność uwikłanych schematów. Przy założeniu, że funkcje dane spełniają nieliniowe oszacowanie typu Perrona względem argumentu funkcyjnego, udowodniono stabilność metody uwikłanej, wykorzystując twierdzenie porównawcze dla funkcji spełniających uwikłane nierówności różnicowe typu Volterry.
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Industrial computer networks and functional safety
PublikacjaW rozdziale monografii przedstawiono wybrane aspekty bezpieczeństwa funkcjonalnego na przykładzie przemysłowych sieci komputerowych stosowanych w obiektach infrastruktury krytycznej. Pierwszą cześć rozdziału poświęcono omówieniu klasycznych rozwiązań w zakresie sieci komputerowych. Drugą część rozdziału stanowi analiza przypadku typowej przemysłowej sieci komputerowej z uwzględnieniem aspektów bezpieczeństwa funkcjonalnego.
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Methodological aspects of functional safety assessment
PublikacjaW artykule przedstawiono aktualne problemy analizy ryzyka i modelowania probabilistycznego w zarządzaniu bezpieczeństwem funkcjonalnym w cyklu życia systemów związanych z bezpieczeństwem. Zostały wyróżnione dwa podstawowe etapy w cyklu życia tych systemów, a mianowicie etap projektowania i etap eksploatacji. Z powodu złożoności i niepewności może być użyteczna w analizie ryzyka i modelowaniu probabilistycznym informacja zarówno...
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Functional differential equations of second order.
PublikacjaPraca dotyczy problemu brzegowego dla równań różniczkowo-funkcyjnych 2-go rzędu. Stosując metodę kwasilinearyzacji pokazano, że odpowiednio skonstruowane ciągi monotoniczne są zbieżne do jedynego rozwiązania danego problemu i ustalono szybkość tej zbieżności. Pokazano również pewną relację pomiędzy rozwiązaniami odpowiednich liniowych równań różniczkowo-funkcyjnych z warunkami brzegowymi.
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Multislice CT in functional cardiac exploration.
PublikacjaArtykuł przedstawia analizę oraz omówienie wykonanych badań w zastosowaniu tomografia wielorzędowej w diagnostyce czynnościowej serca. Pokazano zarówno aspekty technicznej metody jak i możliwości zastosowań medycznych.
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Estimation of Failure Initiation in Laminated Composites by means of Nonlinear Six-Field Shell Theory and FEM
PublikacjaThe monography deals with the problem of failure initiation in thin laminated composites. Known techniques of laminate structures modelling are briefly characterised. Eventually, shell based approach is chosen for the purpose of the description of the composite structures behaviour, as it predicts their deformation and states of stress effectively in a global sense. The nonlinear six parameter shell theory (6p theory) with asymmetric...
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Dempster-shafer theory-based trust and selfishness evaluation in mobile ad hoc networks
PublikacjaThe paper addresses the problem of selfishness detec-tion in mobile ad hoc networks. It describes an approach based on Dempster-Shafer theory of evidence. Special attention is paid to trust evaluation and using it as a metric for coping with (weighted) recommendations from third-party nodes. Efficiency and robustness of the pre-sented solution is discussed with an emphasis on resil-iency to false recommendations.
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Deformation of an elastic second gradient spherical body under equatorial line density of dead forces
PublikacjaWe consider deformations of an elastic body having initially a spherical shape. Assumed deformation energy depends on the first and second gradient of displacements. We apply an equatorial line density of dead loads, that are forces per unit line length directed in radial direction and applied along the equator of the sphere. We restrict ourselves our analysis to the case of linearized second strain gradient isotropic elasticity...
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The impact of filler thermomechanical modifications on static and dynamic mechanical performance of flexible foamed polyurethane/ground tire rubber/zinc borate composites
PublikacjaThe rapid development of the automotive industry is very beneficial to many aspects of human life, but it is also a very significant environmental burden. The most straightforward impact is related to the generation of exhaust, but the management of post-consumer car parts is also a major challenge. Among them, waste tires are very burdensome due to their enormous numbers. Therefore, it is essential to develop novel, environmentally...
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Analytical predictions for the buckling of a nanoplate subjected to non-uniform compression based on the four-variable plate theory
PublikacjaIn the present study, the buckling analysis of the rectangular nanoplate under biaxial non-uniform compression using the modified couple stress continuum theory with various boundary conditions has been considered. The simplified first order shear deformation theory (S-FSDT) has been employed and the governing differential equations have been obtained using the Hamilton’s principle. An analytical approach has been applied to obtain...
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Buckling Analysis of a Micro Composite Plate with Nano Coating Based on the Modified Couple Stress Theory
PublikacjaThe present study investigates the buckling of a thick sandwich plate under the biaxial non-uniform compression using the modified couple stress theory with various boundary conditions. For this purpose, the top and bottom faces are orthotropic graphene sheets and for the central core the isotropic soft materials are investigated. The simplified first order shear deformation theory (S-FSDT) is employed and the governing differential...
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Influence of mesh density on 2D viscous flutter in a turbomachinery cascade
PublikacjaIn this study numerical simulations of 2D viscous flutter were performed and compared with available experimental results for various mesh densities and flow parameters. Calculations were carried out for the bending oscillations of an Eleventh Standard Configuration cascade. ANSYS CFX code was used for the SST, SA and k-ω turbulence model calculations.
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Self-normalized density map (SNDM) for counting microbiological objects
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Spectral density distribution moments as novel descriptors for QSAR/QSPR
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Heart irradiation reduces microvascular density and accumulation of HSPA1 in mice
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Analysis of Factors Influencing the Density of Fatalities on National Roads in Poland
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Cell Density-Dependent Cytological Stage Profile and Its Application for a Screen of Cytostatic Agents Active Toward Leukemic Stem Cells
PublikacjaProliferation and expansion of leukemia is driven by leukemic stem cells (LSCs). Multidrug resistance (MDR) of LSCs is one of the main reasons of failure and relapses in acute myeloid leukemia (AML) treatment. In this study, we show that maintaining HL-60 at low cell culture density or applying a 240-day treatment with anthrapyridazone (BS-121) increased the percentage of primitive cells, which include LSCs determining the overall...
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Theory and application of Near-infrared spectroscopy
PublikacjaIn recent years one can observe a significant increase in the requirements on quality control in all industrial sectors. The growing number of involved analyses makes the traditional, time consuming, requiring use of large quantities of reagents, thus expansive methods inconvenient especially for industrial applications. Fortunately, there is a very fast, cheap and not invasive analytical method that is increasingly used in qualitative...
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Green analytical chemistry : theory and practice
PublikacjaThis tutorial review summarises the current state of green analytical chemistry with special emphasis on environmentally friendly sample preparation techniques. Green analytical chemistry is a part of the sustainable development concept; its history and origins are described. Miniaturisation of analytical devices and shortening the time elapsing between performing analysis and obtaining reliable analytical results are important...
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Note on universal algoritms for learning theory
PublikacjaW 2001 Cucker i Smale zaproponowali nowe podejście do teorii uczenia się w oparciu o problematykę teorii aproksymacji.W 2005 i 2007 Bivev, Cohen, Dahmen, DeVore i Temlyakov opublikowali dwie prace z teorii uczenia się. W omawianej publikacji uogólniliśmy ich rezultaty jednocześnie upraszczając dowody.
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Grand Challenges on the Theory of Modeling and Simulation
PublikacjaModeling & Simulation (M&S) is used in many different fields and has made many significant contributions. As a field in its own right, there have been many advances in methodologies and technologies. In 2002 a workshop was held in Dagstuhl, Germany, to reflect on the grand challenges facing M&S. Ten years on, a series of M& S Grand Challenge activities are marking a decade of progress and are providing an opportunity to reflect...
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Regenarative tourism – between theory and practice
PublikacjaPurpose: The aim of this article is to present a shift in thinking in terms of implementing the systems and practices needed to transition to a regenerative approach in tourism. The article aims to provide concrete ways to change thinking and move towards a regenerative paradigm in the tourism industry. Design/methodology/approach: This viewpoint paper defines regenerative tourism and explores its principles and the possibilities...
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Selected aspects of system design theory.
PublikacjaPrzedstawiono wybrane fragmenty z teorii i techniki projektowania złożonych systemów technicznych. Zwrócono szczególną uwagę na tworzenie schematów strukturalnych i funkcjonalnych systemów, a także występujących tam relacji między elementami takiego systemu. Opisano kolejne kroki postępowania dla doboru cech elementów systemu wg macierzy ich przewidywanych właściwości oraz przykłady podziału dla istniejących składników systemów...
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Selected aspects of system design theory.
PublikacjaPrzedstawiono wybrane zagadnienia z teorii projektowania systemów. Szczgólną uwagę zwrócono na problemy występujące w systemach o dużej złożoności, które charakteryzują się skomplikowaną funkcją globalną, jak również dużą ilością elementów należących do takich systemów. Omówiono także niektóre cechy elementów wynikające z różnych procesów wytwarzania oraz ich wpływ na funkcję, strukturę i eksploatację systemu, powstałego ze skojarzenia...
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On dynamically and kinematically exact theory of shells
PublikacjaW rozważanej dynamicznie i kinematycznie ścisłej teorii powłok, powłokę reprezentuje materialna powierzchnia podstawowa wyposażona w tzw. tensor struktury. Nieograniczoną deformację włókien materialnych przekroju poprzecznego powłoki opisuje wektor przesunięć powierzchni podstawowej i tensor obrotów, wyrażający energetycznie uśrednioną po grubości rotację przekroju. Dyskutowane są relacje między trójwymiarowymi polami w ciele typu...
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Engineering theory and practice: wisdom of thinking
PublikacjaOmówiono wzajemny związek teorii i praktyki w rozwijaniu zawodowych umiejętności inżynierów. Teorię rozumie się tu jako zdolność do kreatywnego myślenia - źródła wszelkiej działalności człowieka. Dlatego należy kłaść nacisk na wysoki poziom kształcenia ogólnego w szkole średniej i na samej uczelni aby w wyniku otrzymać intelektualnie dojrzałych inżynierów-humanistów
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Mixed 4-node shell element with assumed strain and stress in 6-parameter theory
PublikacjaWe propose a mixed hybrid 4-node shell elements based on Hu-Washizu principle. Apart from displacements both strains and stress fields are treated as independent fields. The element is derived in the framework of a general nonlinear 6-field shell theory with drilling rotation which is dedicated to the analysis of multifold irregular shells with intersections. The novelty of the presented results stems from the fact that the measures...
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Mixed 4-node shell element with assumed strain and stress in 6-parameter theory
PublikacjaWe propose a mixed hybrid 4-node shell elements based on Hu-Washizu principle. Apart from displacements both strains and stress fields are treated as independent fields. The element is derived in the framework of a general nonlinear 6-field shell theory with drilling rotation which is dedicated to the analysis of multifold irregular shells with intersections. The novelty of the presented results stems from the fact that the measures...
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Local structural and chemical ordering of nanosized Pt(3±δ)Co probed by multiple-scattering x-ray absorption spectroscopy
PublikacjaThis 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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Novel primosomal protein B from thermophilic bacterium Thermoanerobacter tengcongensis
PublikacjaWe report the identification and characterization of theprimosomal protein B (PriB) from thermophilic bacteriumThermoanerobacter tengcongensis (TtePriB). It is the largestknown bacterial PriB protein consisting 216 amino acidresidues with a calculated molecular mass of 25 kDa. Surprisingly,it is functional as monomer containing two single-stranded DNA binding domain (OB-fold) and it is thecompletely new kind structure of SSB protein....
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An application of simulation model of fuel consumption in diagnostic system of wheeled tractors
PublikacjaAn application of computer controlled fuel injection systems in vehicle engines and growing demands concerning toxic substances emission and fuel consumption was a main reason for OBD (On Board Diagnosis) development. In spite of a great technological development, only some tractors are equipped in diagnostic systems. On board diagnostic is strongly connected with emission demands and does not concern other important vehicle functions. In...
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Nowe zakresy kreowania wizerunku fasad przy zastosowaniu technologii filtrów optycznych.
PublikacjaModern facades, whether made of glass or including transparent, translucent or reflective elements, let through a particular light spectrum or change its intensity in many different ways. “Filtering facades” may change the image seen through them or change the colour of passing light according to specific circumstances: the angle of observation or temperature. These indicated properties of facades acting as “filters” were made...
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"Food Oxidants and Antioxidants" Book review
PublikacjaThe book is the 14th title in the CRC series Chemical and Functional Properties of Food Components, edited since 2001 by Zdzisław E. Sikorski. The editor of the book, a professor in the University of Łódź and member of the Polish Academy of Sciences, is an internationally recognized authority in biochemistry and biophysics of reactive oxygen species. In Poland Grzegorz Bartosz has a reputation as the author of his most interesting...
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Experimental bases for the rail track surface damage detection system
PublikacjaA diagnosis of rail surface is generally based on the classical method of direct assessment and track geometry measurements. Identification and qualification of inequality and damage on the surface rails is depend on the skills and experience person who conducting inspection. In times of increasing exploitation of railways, infrastructure managers decide to use systems supporting the assessment of technical condition of the railways....
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Cold-Active beta-Galactosidases: Sources, Biochemical Properties and Their Biotechnological Potential
Publikacjabeta-D-Galactosidases have been studied extensively in terms of their application to a variety of industrial technologies. To date, considerable research efforts have been devoted to characterization of new cold-active beta-D-galactosidases which were isolated directly from selected species of bacteria and yeasts, as well as with the use of metagenomic approaches. This chapter will provide a review of current research towards cold-active...
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Potential of Polish R&D industry in the context of prototyping, design, development and control of a dedicated national satellite SAR system for marine ecosystem monitoring. Technical paper - preliminary study
Publikacjapace technology is currently one of the most important elements in the advance of information societies and knowledge-based economies all over the world. The European Space Agency (ESA) is in the focal point of European space activities, while the European Union provides strong financial support for the development of space technologies and applications in its flagship programs. In a domestic scope, the Polish Space Agency (POLSA)...
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Cache service for maps presentation in distributed information data exchange system
PublikacjaThe paper presents the proposition of caches implementation for map presentation in distributed information data exchange system. The concept of cache service is described in the context of distributed information data exchange system elements which control and present on maps positions and other identification data of vessels and other suspicious objects on the territorial sea, sea-coast and the internal sea-waters. The proposed...
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Antioxidant Interactions between Major Phenolic Compounds Found in 'Ataulfo' Mango Pulp: Chlorogenic, Gallic, Protocatechuic and Vanillic Acids
PublikacjaPhenolic compounds are known to have antioxidant capacity; however, there is little information about molecular interactions between particular phenolics found in fruits at different developmental stages. Therefore, the total antioxidant capacity of the phenolic compounds of a fruit may not correspond to the sum of individual antioxidant capacity given by antioxidants from that tissue. In this study, individual antioxidant capacity...
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Fuctional structure of diagnostic system for wheeled tractors
PublikacjaAn application of computer controlled fuel injection systems in vehicle engines and growing demands concerning toxic substances emission and fuel consumption was a main reason for OBD (On Board Diagnosis) development. In spite of a great technological development, only some tractors are equipped in diagnostic systems. On board diagnosis is strongly connected with emission demands and does not concern other important vehicle functions.In...