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Search results for: SULFUR FUNCTIONAL GROUPS
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The ONETEP linear-scaling density functional theory program
PublicationWe present an overview of the ONETEP program for linear-scaling density functional theory (DFT) calculations with large basis set (planewave) accuracy on parallel computers. The DFT energy is computed from the density matrix, which is constructed from spatially localized orbitals we call Non-orthogonal Generalized Wannier Functions (NGWFs), expressed in terms of periodic sinc (psinc) functions. During the calculation, both the...
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Obtaining of coumarone-indene resins based on light fraction of coal tar.1. Coumarone-indene resins with carboxy groups
PublicationCoumarone-indene resins (CIR) with carboxy groups were synthesized via cooligomerization of unsaturated compounds presented in ligh fraction of coal tar and its fraction boiling out within 423-463 K with the addition of such industrial monomers as styrene, maleic anhydride, glycidyl methacrlate and methacryclic acid. 2,2-azobs 92-methylpropionitrile) in the form of 0,2 M solution in toluene was used as an initiator. The effect...
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Light formed through urban morphology and different organism groups: First findings from a systematic review
PublicationThe prevailing implementation and usage of contemporary lighting technologies and design practices in cities have created over-illuminated built environments. Recent studies indicate that exposure to electric lighting effects formed through spatial characteristics has visual, physiological, and behavioural effects on both humans and non-humans, such as wildlife. In order to gain a better understanding of the impact that electric...
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Synthesis and application of oligomer with hydroxy groups based on peroxy derivative of ED-24 epoxy resin and POLYTHF-2000 oligoether
PublicationNew oligomer with peroxy, primary and secondary hydroxy groups has been synthesized on the basis of peroxy derivative of ED-24 epoxy resin (PO) and PolyTHF-2000 oligoether according to the developed procedure. The effect of the catalysts nature and amount, temperature and process time on the reaction rate has been studied. Benzyltriethylammonium chloride, potassium hydroxide,1,4-diazobicyclooctane and the mixture composed of benzyltriethylammonium...
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Integrated Functional Safety and Cybersecurity Evaluation in a Framework for Business Continuity Management
PublicationThis article outlines an integrated functional safety and cybersecurity evaluation approach within a framework for business continuity management (BCM) in energy companies, including those using Industry 4.0 business and technical solutions. In such companies, information and communication technology (ICT), and industrial automation and control system (IACS) play important roles. Using advanced technologies in modern manufacturing...
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The impact of security aspects on functional safety analysis = Wpływ aspectów ochrony informacji na wyniki analiz bezpieczeństwa funkcjonalnego
PublicationIt can be said that a distributed control and protection system’s security level may have a significant impact on functional safety analyses and their results. However the issue of integrating those both aspects are difficult and usually is neglected during functional safety analyses. Known methods of functional safety analyses don’t take into consideration this kind of concept also. This paper discusses an attempt to integrate...
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Novel Tools for Comprehensive Functional Analysis of LDLR (Low-Density Lipoprotein Receptor) Variants
PublicationFamilial hypercholesterolemia (FH) is an autosomal-dominant disorder caused mainly by substitutions in the low-density lipoprotein receptor (LDLR) gene, leading to an increased risk of premature cardiovascular diseases. Tremendous advances in sequencing techniques have resulted in the discovery of more than 3000 variants of the LDLR gene, but not all of them are clinically relevant. Therefore, functional studies of selected variants...
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Influence of substituents in vinyl groups on reactivity of parylene during polymerization process
PublicationPraca zawiera wyniki obliczeń kwantowych wielokonfiguracyjnych i DFT mechanizmów reakcji parylenu i cząsteczek z wiązaniami podwójnymi w fazie gazowej. Zbadany został i zanalizowany wpływ podstawników w strukturach alkenów na reaktywność parylenu i alkenów.
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The Effect of Aromatic Diimide Side Groups on the π-Conjugated Polymer Properties
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New Method for the Synthesis of Azocrown Compounds Containing Oxygen, Nitrogen and Oxygen, or Sulfur Atoms in the Macroring.
PublicationW publikacji opisano nową metodę syntezy azokoron z różnymi heteroatomami w makrocyklu i o różnej wielkości molekularnej wnęki. Metoda ta polega na reakcji 2,2´-difluoroazobenzenu z diolami, diaminami, aminodiolami i ditiolamiw obecności zasady.
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Urban regeneration in urban functional areas in Poland as an instrument of implementation of the EU Cohesion Policy
PublicationThis study examines the role of urban regeneration policies in planning and governance within urban functional areas (UFAs) in Poland, in the context of the EU Cohesion Policy (CP). The empirical part of this study is based on comparing the approaches adopted in two Polish regions: Pomerania and Silesia. We describe the first successes but also the bottlenecks of the process, from negotiations and programming up to the implementation...
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Application of dispersive liquid - liquid microextraction for determination of pesticides from various chemical groups in water samples
PublicationPesticides are a global risk because they move with the wind, rain and sea currents from other regions, which makes getting to places which were never used before. Their presence was detected in all types of water circulating in the ecosystem, which is an easy source of exposure to life and health of all living organisms. Currently, it is considered one of the most dangerous and toxic pollutants, which fate and function is still...
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The significance of institutions' potential to increase Youth civic participation – case study of the South Baltic Youth Core Groups Network Project
PublicationYoung people are a very important group of modern societies, they will replace the currently ruling generation and will shape our common future. Due to that, young people have become the relevant target of national and international policy and science researches. Youth civic participation is a key aspect of the development of a society and should be shaped by effective youth policy at the national and international levels. This...
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CeCu2O4 as a functional layer on solid oxide fuel cells for synthetic biogas reforming
PublicationSolid Oxide Fuel Cells (SOFC) are one of the most promising electrochemical devices, which can convert chemical energy to the electrical energy these days. Their ability to work with different kind of fuel makes them noteworthy. SOFC can work with biogas. The problem arises when solid carbon starts to be deposited in anode. That leads to degradation of fuel cell. Simple solution is to apply catalytic functional layer, which is...
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Highly effective degradation of selected groups of organic compounds by cavitation based AOPs under basic pH conditions
PublicationCavitation has become on the most often applied methods in a number of industrial technologies. In the case of oxidation of organic pollutants occurring in the aqueous medium, cavitation forms the basis of numerous advanced oxidation processes (AOPs). This paper presents the results of investigations on the efficiency of oxidation of the following groups of organic compounds: organosulfur, nitro derivatives of benzene, BTEX, and...
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Implicit difference functional inequalities and applications
PublicationKlasyczne 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
PublicationW 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
PublicationW 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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Approximate methods for functional differential equations
PublicationW 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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Functional differential equations of second order.
PublicationPraca 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.
PublicationArtykuł 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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Integrated approach for functional safety and cyber security management in maritime critical infrastructures
PublicationThe work is devoted important issues of the management in maritime critical infrastructure of functional safety analysis, in particular the safety integrity level (SIL) verification of safety functions to be implemented within the distributed control and protection systems with regard to cyber security aspects. A method based on quantitative and qualitative information is proposed for the SIL (IEC 61508, 61511) verification with...
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Functional safety in the context of risk appraisal criteria and cost-benefit analysis
PublicationRozdział przedstawia aktualne zagadnienia dotyczące analizy kosztów i efektów rozwiązań związanych z bezpieczeństwem na przykładzie systemów elektrycznych, elektronicznych i programowalnych elektronicznych (E/E/PE) pełniących funkcje sterowania i zabezpieczeń w obiektach podwyższonego ryzyka. Podkreśla się znaczenie kryteriów związanych z bezpieczeństwem, takich jak tolerowalność ryzyka (TOR) w kontekście analizy kosztów i efektów...
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Systems engineering approach to functional safety and cyber security of industrial critical installations
PublicationThis chapter addresses the systems engineering approach to integrated functional safety and cybersecurity analysis and management regarding selected references, standards and requirements concerning critical installations and their industrial automation and control system (IACS). The objective is to mitigate the vulnerability of industrial installations that include the information technology (IT) and the operational technology...
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Systems engineering approach to functional safety and cyber security of industrial critical installations
PublicationThis chapter addresses the systems engineering approach to integrated functional safety and cybersecurity analysis and management regarding selected references, standards and requirements concerning critical installations and their industrial automation and control system (IACS). The objective is to mitigate the vulnerability of industrial installations that include the information technology (IT) and the operational technology...
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A method for the three-dimensional and synchronous resolution of functional and spatial matters in architectural design
PublicationThe article discusses the issue of applied methods of teaching architectural design at Polish universities. The authors review the common methods based on conceptual drawings solving design problems in only two dimensions. After completing the floor plans' sketching process carried out in 2D way the 3D virtual models are made - seldom cardboard mock-ups - to illustrate the final spatial form of the designed object. At the Faculty...
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Molecular basis for the bifunctional Uba4–Urm1 sulfur‐relay system in tRNA thiolation and ubiquitin‐like conjugation
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Human Factors and Functional Safety Analysis in Designing the Control Rooms of Industrial Hazardous Plants
PublicationIn this work some aspects of human factors and functional safety analysis in designing the control rooms of industrial hazardous plants are presented. The “defence in depth” (D-in-D) concept is outlined. Some designing issues of the alarm system (AS) with regard to human factors to be supported using the human reliability analysis (HRA) are discussed. The AS and decision support system (DSS), when properly designed, would contribute...
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The Comparison Between the Calculated and HPLC-Predicted Lipophilicity Parameters for Selected Groups of Drugs
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Consumer Perceptions of Peanuts and Peanut Allergy: The EuroPrevall Results of Focus Groups in Poland
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X-ray and NMR structural studies of the series of porphyrazines with peripheral pyrrolyl groups
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Synthesis and characterization of periphery-functionalized porphyrazines containing mixed pyrrolyl and pyridylmethylamino groups
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Synthesis, characterization, photochemical properties and cytotoxicity of the novel porphyrazine functionalized with nitroimidazolylbutylsulfanyl groups
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Cyanido-Bridged Clusters with Remote N-Oxide Groups for Branched Multimetallic Systems
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Hybrid materials comprising trimethylglycinamide groups: immobilization consequences for anion binding affinities
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Comparative model tests of SDP and CFA pile groups in non-cohesive soil
PublicationThe research topic relates to the subject of deep foundations supported on continuous flight auger (CFA) piles and screw displacement piles (SDP). The authors have decided to conduct model tests of foundations supported on the group of piles mentioned above and also the tests of the same piles working alone. The tests are ongoing in Geotechnical Laboratory of Gdańsk University of Technology. The description of test procedure, interpretation...
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Modelling and simulation of striated muscle and groups of muscles in arm-forearm system 2D
PublicationModel mięśnia szkieletowego poprzecznie prążkowanego został przedstawiony jako szeregowe połączenie aktywnych i pasywnych odcinków reologicznych. Zasymulowane zostały: skurcze pojedyncze, niecałkowity skurcz tężcowy, całkowity skurcz tężcowy. Model zespołu mięśni w układzie ramię-przedramię opisu-je zmianę kąta obrotu przedramienia względem nieruchomego ramienia. Pobudzając zginacze i prostowniki był zasymulowany obrót przedramienia.
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A New Approach to Assess Quality of Motion in Functional Task of Upper Limb in Duchenne Muscular Dystrophy
Publication(1) Background: This study presents a new method for the motion quantitative analysis of Duchenne muscular dystrophy patients (DMD) performing functional tasks in clinical conditions. (2) Methods: An experimental study was designed to define how different levels of external mass (light and heavy) influence the performance of the upper limbs of a tested DMD and reference subject (RS) during horizontal movements (level of the waist)...
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Methodological issues of functional safety and reliability assessment of critical systems in industrial hazardous plants
PublicationThe aim of this article is to identify and discuss some methodological issues that are of interest among functional safety specialists and experts after publication of the second edition of international standards IEC 61508 and IEC 61511, including the design and implementing the safety-related functions of higher safety integrity levels and protection layers. The basic role of safety-related systems is to reduce effectively and...
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The impact of training and neurotrophins on functional recovery after spinal cord transection: cellular and molecular mechanisms contributing to motor improvement
PublicationBeneficial effects of locomotor training on the functional recovery after complete transection of the spinal cord indicate that in chronic spinal animals spontaneous recovery processes are enhanced and shaped by the training. The mechanisms of that use-dependent improvement are still not fully understood. This review tackles three aspects of this issue: (1) neurochemical attributes of functional improvement...
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COMBINING FUNCTIONAL AND AESTHETIC ASPECTS OF DAYLIGHTING IN SUSTAINABLE ARCHITECTURE WITH THE USE OF DIGITAL DESIGN METHODS
PublicationThe aesthetics of modern architecture should relate to its origins and goals - the environment, function, sustainability and its users. One of the conditions that meet the criteria is the presence of daylight and the use of its potential. The contemporary digital tools that support the design process allow to controlling the use of difficult and capricious materials, such as daylight. They also combine daylighting aspects with...
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ProSIL Software for functional saferty management in life cycle = Aplikacja ProSIL do zarządzania bezpieczeństwem funkcjonalnym w cyklu życia
PublicationIn the paper the ProSIL software to aid the functional safety management is presented. The software consists of three modules to aid: determination of the required SIL level (ProSILen), veryfication of the SIL level (ProSILver). In the aplication the method of the calibrated risk graph to determine the required safety integrity level SIL for defined safety instrumented functions is applied. The methods concerning functional safety...
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Upgrading low value-added activities in global value chains: a functional specialisation approach
PublicationThis paper aims to identify patterns of functional specialisation (FS) in global value chains (GVCs) and determinants of upgrading them for selected Central Eastern European (CEE) economies. By combing the World Input-Output Database with data on occupations, we reveal a new FS pattern among subgroups of CEEs. Poland and Slovakia have an unfavourable GVC position and specialise in low value-added fabrication function. In contrast,...
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First-order impulsive functional differential equations
PublicationPraca dotyczy problemów istnienia rozwiązań i kwazi-rozwiązań dla równań różniczkowych rzędu pierwszego z impulsami i nieliniowymi warunkami brzegowymi. Operator występujący w zagadnieniu jest typu opóźnionego. Badano również nierówności różniczkowe z impulsami związane z zagadnieniem wyjściowym. Otrzymane wyniki zilustrowano na przykładach.
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Functional safety analysis including human factors
PublicationThe article addresses selected aspects of human factors that should be taken into account during the design of safety-related functions for a complex hazardous installation and its protections. In such installations the layer of protection analysis (LOPA) methodology is often used for simplified risk analysis based on defined accident scenarios. To control the risk the safety instrumented functions (SIFs) are identified and their...
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Functional Safety Analysis including Human Factors
PublicationIn this paper selected aspects of human factors are discussed that should be taken into account during the design of safety-related functions for a complex hazardous installation and its protections. The layer of protection analysis (LOPA) methodology is used for simplified risk analysis based on defined accident scenarios. To control the risk the safety instrumented functions (SIFs) are identified and their safety integrity levels...
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Chemical, biological and functional aspects of food lipids
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Measures of Functional Reliability of Two-Lane Highways
PublicationRural two-lane highways are the most common road type both in Poland and globally. In terms of kilometres, their length is by far greater than that of motorways and expressways. They are roads of one carriageway for each direction, which makes the overtaking of slower vehicles possible only when there is a gap in the stream of traffic moving from the opposite direction. Motorways and express roads are dual carriageways that are...
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Approximation of extremal solutions for functional differential equations
PublicationDyskutowane są równania różniczkowe funkcyjne z liniowym warunkiem brzegowym. Podano warunki dostateczne dla istnienia ciągów monotonicznych, aproksymujących rozwiązania ekstremalne badanych zagadnień.
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Functional safety and security management in critical systems
PublicationGłównym celem referatu jest przedstawienie wybranych kwestii zarządzania bezpieczeństwem i ochroną w systemach podwyższonego ryzyka i systemach krytycznych. Zarysowuje się kilka praktycznych problemów analizy bezpieczeństwa funkcjonalnego w celu podejmowania decyzji zgodnie z normami międzynarodowymi IEC 61508 i IEC 61511. Podkreśla się, że aspekty związane z ochroną powinny być starannie rozpatrzone zarówno w fazie projektowania,...