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Wyniki wyszukiwania dla: KATION HYDROFOBOWY
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EUDEM2: Overview and some early fingings.
PublikacjaW pracy przedstawiono wyniki rekonstrukcji dla obiektu trójwymiarowego, roz-ciągającego się do nieskończoności. Pokazano możliwe sposoby sprowadzenia problemu nieokreślonego do nadokreślonego. Pokazano przykładowe kształty op-tymalnych funkcji pobudzających.
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Analiza ruchowa pojazdów szynowych z uwzględnieniem zmian napięcia na odbieraku prądu
PublikacjaW artykule zaproponowano metodykę wykonywania analizy ruchowej pojazdów szynowych, która uwzględnia wpływ zmieniającego się napięcia zasilającego pojazd a jego właściwości ruchowe. Wykorzystując model opracowany w programie Simulink wskazano na istotne różnice w czasie przejazdu oraz w wartościach napięcia zasilającego pomiędzy proponowanym sposobem analizy a powszechnie stosowanym podejściem uproszczonym.
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Effect of nitrogen doping on TiOxNythin film formation at reactive high-power pulsed magnetron sputtering
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Electrochemistry from first-principles in the grand canonical ensemble
PublikacjaProgress in electrochemical technologies, such as automotive batteries, supercapacitors, and fuel cells, depends greatly on developing improved charged interfaces between electrodes and electrolytes. The rational development of such interfaces can benefit from the atomistic understanding of the materials involved by first-principles quantum mechanical simulations with Density Functional Theory (DFT). However, such simulations are...
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Assessment of Citizens’ Actions against Light Pollution with Guidelines for Future Initiatives
PublikacjaDue to the wide reach of media reports about scientific research and technological tools such as the world wide web (WWW), the Internet, and web browsers, citizens today have access to factual information about the negative impact of artificial light at night (ALAN) on their dark skies, and their health and well-being. This means they can now make educated decisions and take the necessary steps to help protect themselves and their...
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Two families of infinitely many homoclinics for singular strong force Hamiltonian systems
PublikacjaWe are concerned with a planar autonomous Hamiltonian system with a potential possessing a single well of infinite depth at a point X and a unique strict global maximum 0 at a point A. Under a strong force condition around the singularity X, via minimization of an action integral and using a shadowing chain lemma together with simple geometrical arguments, we prove the existence of infinitely many geometrically distinct homoclinic...
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Challenges associated with the design of a small unmanned autonomous maritime vehicle
PublikacjaThe paper contains the preliminary results of the research connected with development of a small unmanned autonomous maritime vehicle. First of all a general description of research is introduced. Next, a concept of a vehicle is presented. Then, a brief description of a research method is given. Next, the current research problems under way are introduced. They concern the ballasting, motion and precise position stabilization system...
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A Surveillance Of Dynamic Processes in Selected Mechatronic Systems
PublikacjaThe paper concerns development of original method of optimal control at energy performance index and its application to dynamic processes surveillance of some mechatronic systems. The latter concerns chatter vibration surveillance during highspeed slender milling of rigid details, as well as motion control of two-wheeled mobile platform. Results of on-line computer simulations and real performance on the target objects reflect...
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Ionic hydration in LiPF6, NaPF6, and KPF6 aqueous solutions derived from infrared HDO spectra.
PublikacjaZbadano hydratację LiPF6, NaPF6 oraz KPF6 przy pomocy metody FTIR, z zastosowaniem techniki rozcieńczenia izotopowego HDO w H2O. Dane widmowe poddano analizie metodą ważonych widm różnicowych. Główne wnioski pracy stanowią uzupełnienie i rozszerzenie pasmowego modelu hydratacji kationów, wcześniej postulowanego na podstawie widm w podczerwieni HDO wodnych roztworów różnych elektrolitów.
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Gradient versus proper gradient homotopies
PublikacjaWe compare the sets of homotopy classes of gradient and proper gradient vector fields in the plane. Namely, we show that gradient and proper gradient homotopy classi cations are essentially different. We provide a complete description of the sets of homotopy classes of gradient maps from R^n to R^n and proper gradient maps from R^2 to R^2 with the Brouwer degree greater or equal to zero.
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Apparent molar volumes of divalent transition metal chlorides and perchlorates in dimethyl sulfoxide solutions.
PublikacjaZmierzono gęstości roztworów nadchloranów i chlorków dwuwartościowych metali szeregu Mn(II)-Zn(II) w dimetylosulfotenku. Wyznaczone na drodze ekstrapolacji cząstkowe objętości molowe nadchloranów rozdzielono na udziały jonowe. Przeanalizowano wpływ pola ligandów na cząstkowe objętości molowe kationów. Przedstawiono związek między wartościami pozornych objętości molowych a stanami koordynacyjnymi soli w DMSO.
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Water Behavior Near the Lipid Bilayer
PublikacjaIn this chapter, we focus on the dynamics of water molecules situated in the vicinity of a phospholipid bilayer. Using a molecular dynamics simulation method, we studied interactions between water and the bilayer and tracked trajectories of the water molecules. Based on the hypothesis that molecules trapped inside the bilayer make different motions than the ones which are either attached to the surface or move freely in the water...
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Corrugated Sheeting as a Member of a Shear Panel Under Repeated Load—Experimental Test
PublikacjaIn stressed-skin design, the cladding stiffening effect on structures is taken into account. However, the “traditional” design is more usual, wherein this effect is neglected. Even if the diaphragm actions are not regarded, in particular cases such as big sheds (and others), the parasitic (unwanted) stressed-skin action may occur with the result of leakage or even failure. The structures of this kind have already been built. Thus,...
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H2O˙+ and OH+ reactivity versus furan: experimental low energy absolute cross sections for modeling radiation damage
PublikacjaRadiotherapy is one of the most widespread and efficient strategies to fight malignant tumors. Despite its broad application, the mechanisms of radiation-DNA interaction are still under investigation. Theoretical models to predict the effects of a particular delivered dose are still in their infancy due to the difficulty of simulating a real cell environment, as well as the inclusion of a large variety of secondary processes. This...
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Raczej wydajność materiałowa niż liniowa. Spotkania: Europejska współpraca w Obszarze Badań Naukowych i Technicznych
PublikacjaW artykule przedstawiono ogólną charakterystykę tematyki Warsztatów w Honeffoss (Norwegia). Warsztaty Grupy Roboczej 3 (WG3), działającej w ramach programu europejskiego COST Action E35, odbyły się w sierpniu tego roku i poświęcone były zwiększaniu wydajności materiałowej drewna w przerobie pierwotnym i wtórnym. Uczestnikami Warsztatów byli przedstawiciele Francji, Hiszpanii, Norwegii, Polski i Włoch.
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A SHORT REVIEW OF BLOOD FLOW MODELLING METHODS: FROM MACRO- TO MICROSCALES
PublikacjaThe aim of this paper it to review various scale approaches to the blood flow modelling. Blood motion may be described by three types of mathematical models according to the observed scales or resolutions, namely microscopic, mesoscopic and macroscopic descriptions. The above approaches are discussed together with their advantages and disadvantages. Several results of mesoscopic simulations are presented with particular attention...
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Self-organization of imidazolium ionic liquids in aqueous solution
PublikacjaW pracy przeanalizowano i podsumowano wyniki badań nad samoorganizacją oraz tworzeniem micel cieczy jonowych w roztworach wodnych otrzymane przez wiele zespołów badawczych. Średnio i długołańcuchowe imidazoliowe ciecze jonowe wykazują aktywność powierzchniową zależną od długości łańcucha alkilowego w kationie, analogicznie do kationowych surfaktantów. Wskazano na liczne zagadnienia, które wymagają dalszych systematycznych badań
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Evolutionary Sets of Safe Ship Trajectories: the Method's Development and Selected Reaserch Results
PublikacjaThe Evolutionary Sets of Safe Ship Trajectories is a method solving ship encounter situations. The method combines evolutionary approach to planning ship trajectory with some of the assumption of game theory. For given positions and motion parameters the method finds a near optimal set of safe trajectories of all ships involved in an encounter. This paper presents framework of the method and its development. Additionally, selected...
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On solvability of initial boundary-value problems of micropolar elastic shells with rigid inclusions
PublikacjaThe problem of dynamics of a linear micropolar shell with a finite set of rigid inclusions is considered. The equations of motion consist of the system of partial differential equations (PDEs) describing small deformations of an elastic shell and ordinary differential equations (ODEs) describing the motions of inclusions. Few types of the contact of the shell with inclusions are considered. The weak setup of the problem is formulated...
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Generalized Gradient Equivariant Multivalued Maps, Approximation and Degree
PublikacjaConsider the Euclidean space Rn with the orthogonal action of a compact Lie group G. We prove that a locally Lipschitz G-invariant mapping f from Rn to R can be uniformly approximated by G-invariant smooth mappings g in such a way that the gradient of g is a graph approximation of Clarke’s generalized gradient of f . This result enables a proper development of equivariant gradient degree theory for a class of set-valued gradient...
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Studying the Behaviour of Pedestrians and Drivers Within Pedestrian Crossings
PublikacjaEvery third road accident in Poland involves a pedestrian as a participant or, most of the time, a casualty. Pedestrian accidents are usually the result of complex situations and the outcome of a number of factors related to driver and pedestrian behaviour and road infrastructure. Safety depends largely on how well the traffic condition is perceived and on visibility in traffic. The re-lations between pedestrians and motorists...
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Dynamika bezzałogowego aparatu latającego w układzie czterowirnikowego pionowzlotu
PublikacjaDziałanie maszyn, w tym również pojazdów latających, jest nieodłącznie związane z przekazywaniem oddziaływań siłowych: statycznych i dynamicznych. Dynamika jest działem mechaniki zajmującym się makroskopowym ruchem ciał przy uwzględnieniu przyczyn wywołujących ten ruch. Pierwszym etapem analizy dynamiki konstrukcji są zwykle obliczenia wartości i postaci drgań własnych modelu konstrukcji. Drgania własne zwykle ulegają szybkiemu...
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Thermodynamic and geometrical characteristics of mixed convection heat transfer in the shell and coil tube heat exchanger with baffles
PublikacjaThe article presents passive heat transfer enhancement method in the form of baffles to increase the energy efficiency of the shell coil heat exchanger. Conducted literature review shows that, despite numer- ous studies, there is little work on the intensification of heat transfer at the shell side. Most of the work focuses on the impact of geometrical parameters of the coil itself. This article successfully proves that it is possible...
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A Centralized Reputation System for MANETs Based on Observed Path Performance
PublikacjaA reputation system for MANETs is described that attempts to deduce nodal trustworthiness (forwarding behaviour) from observed end-to-end path performance. The trustworthiness deduction algorithm produces interval estimates and works well if node misbehaviour is not selec-tive with respect to traversing paths. Nodal reputation levels are next calculated in the spirit of generous tit-for-tat so as to best reflect momentary nodal...
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Understanding the capacitance of thin composite films based on conducting polymer and carbon nanostructures in aqueous electrolytes
PublikacjaIn this work electrochemical performance of thin composite films consisted of poly(3,4-ethylenedioxythiophene) (PEDOT), graphene oxide (GOx) and oxidized multiwalled carbon nanotubes (oxMWCNTs) is investigated in various sulphates (Li2SO4, Na2SO4, K2SO4, MgSO4) and acidic (H2SO4) electrolytes. Capacitance values, rate capability and cycling stability achieved for the composite layers are correlated with the electrolytes’ properties...
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Thermodynamic study of binary mixtures of 2-propanol with ionic liquids, 1-hexyl-3-methylimidazolium bis(trifluoromethylsulfonyl)imide, 1-hexyl-3-methylimidazolium trifluoromethanesulfonate and triethylhexylammonium bis(trifluoromethylsulfonyl)imide
PublikacjaIn this work, densities, speeds of sound, refractive indices and viscosities of three binary mixtures containing the ionic liquids 1-hexyl-3-methylimidazolium bis(trifluoromethyl-sulfonyl)imide, 1-hexyl-3-methylimidazolium trifluoromethanesulfonate and triethylhexyl-ammonium bis(trifluoromethylsulfonyl)imide, mixed with 2-propanol at wide temperature and composition ranges at atmospheric pressure have been measured. From these...
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Detection, identification and determination of chiral pharmaceutical residues in wastewater: Problems and challenges
PublikacjaChiral pharmaceuticals (CPs) are widely used in different areas of human life, thus they are frequentlydetected in different ecosystems. However, before CPs reach the environment, wastewater is subjected todifferent treatment processes in order to remove them. Nevertheless, such processes may affect thechirality of CPs, thus it is very important to monitor CP levels during the wastewater treatment.This review addresses the present...
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Analysis of the Ways to Identify Rail Running Surface Defects by Means of Vibration Signals
PublikacjaTh e article discusses a preliminary concept of a method enabling the identifi cation of chosen rail running surface defects, such as squats, spalling, and running surface defects, by analysing the parameters of vibration signals. It features a description of the methodology of the conducted tests, the scope thereof, and the selection of the measurement points with specifi c defect types. Th e article covers selected results of...
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Correlation between natural frequencies and buckling load in a stiffened shell
PublikacjaThe paper deals with correlation between natural frequencies and buckling load of a stiffened shell composed of corrugated sheets and vertical stiffeners (columns). The simplified shell segment represents the buckling behaviour of a whole silo with sparsely distributed columns. The paper covers variants of linear buckling anal-yses, dynamic eigenvalue analyses and geometrically non-linear analyses of a segment modelled with shell...
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Approaches to Static Digestion Models
PublikacjaIt is not possible to look in detail at the wide range of static digestion methods that have been used to date. However, this section looks at some of the general approaches that have been used to look at the digestion of various nutrients and bioactives. I have focussed on the two main nutrients that undergo digestion in the upper GI tract, namely protein and lipid. In the case of protein, the research has largely been driven...
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Modeling of performance and safety of a multi-task unmanned autonomous maritime vehicle = Modelowanie ruchu i bezpieczeństwa wielozadaniowego bezzałogowego autonomicznego pojazdu wodnego
PublikacjaAt the beginning of the paper the aim of research is presented. Then the method is introduced. Next, the unmanned autonomous maritime vehicle is briefly described. The following chapter concerns a model of vehicle performance including the ballasting and motion. Some information on an integrated steering, positioning and stabilization system of the vehicle is briefly presented in the paper. Such the system enables to obtain a fully...
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Verification of the criteria for evaluation of water and frost resistance of asphalt concrete
PublikacjaThe paper presents the results of field investigation - condition survey of existing pavements and the results of laboratory tests on water and frost resistance of samples cored from the these pavements. The purpose of testing was to verify the criteria for evaluation of the resistance of asphalt concrete to the action of water and frost by way of comparing the results of field and laboratory tests, followed by evaluation of their...
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Module of priorities for public transport vehicles in the TRISTAR system
PublikacjaOne of the most important elements of the intelligent traffic control systems is the ability to control movement in such a way as to privilege the selected users movement, in particular public transport vehicles. Implemented at the Tri-City the TRISTAR system will also have a module for prioritizing public transport vehicles. The article presents a characteristics of the priority action system: the way of communication with the...
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Autonomous port management based AGV path planning and optimization via an ensemble reinforcement learning framework
PublikacjaThe rapid development of shipping trade pushes automated container terminals toward the direction of intelligence, safety and efficiency. In particular, the formulation of AGV scheduling tasks and the safety and stability of transportation path is an important part of port operation and management, and it is one of the basic tasks to build an intelligent port. Existing research mainly focuses on collaborative operation between...
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Copper(II) complexes of 7-amino-2-methylchromone and 7-aminoflavone: Magneto-structural, spectroscopic and DFT characterization
PublikacjaFour new complexes of copper(II) consisting of two different chromone derivatives with carbonyl and amine donor atoms: 7-aminoflavone (L1) and 7-amino-2-methylchromone (L2), were synthesized and characterized by X-ray diffraction, UV–Vis, FT-IR, EPR spectroscopy, MS and elemental analysis. In all four compounds, the chromone derivatives were found to act as monodentate O- or N-ligands. The structural characteristics of 1a and...
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The Recent Past and Possible Futures of Citizen Science: Final Remarks
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Combination therapy in the management of hypertension — current problem in Poland. Expert consensus statement of the Polish Society of Hypertension and Polish Cardiac Society Working Group on Cardiovascular Pharmacotherapy
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Synthesis, resolution, and chiroptical properties of hemicryptophane cage controlling the chirality of propeller arrangement of a C 3 triamide unit
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Hydroperoxyl radical and formic acid formation from common DNA stabilizers upon low energy electron attachment
Publikacja2-Amino-2-(hydroxymethyl)-1,3-propanediol (TRIS) and ethylenediaminetetraacetic acid (EDTA) are key components of biological buffers and are frequently used as DNA stabilizers in irradiation studies. Such surface or liquid phase studies are done with the aim to understand the fundamental mechanisms of DNA radiation damage and to improve cancer radiotherapy. When ionizing radiation is used, abundant secondary electrons are formed...
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TINKTEP: A fully self-consistent, mutually polarizable QM/MM approach based on the AMOEBA force field
PublikacjaWe present a novel quantum mechanical/molecular mechanics (QM/MM) approach in which a quantum subsystem is coupled to a classical subsystem described by the AMOEBA polarizable force field. Our approach permits mutual polarization between the QM and MM subsystems, effected through multipolar electrostatics. Self-consistency is achieved for both the QM and MM subsystems through a total energy minimization scheme. We provide an expression...
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Practical Approach to Large-Scale Electronic Structure Calculations in Electrolyte Solutions via Continuum-Embedded Linear-Scaling Density Functional Theory
PublikacjaWe present the implementation of a hybrid continuum-atomistic model for including the effects of a surrounding electrolyte in large-scale density functional theory (DFT) calculations within the Order-N Electronic Total Energy Package (ONETEP) linear-scaling DFT code, which allows the simulation of large complex systems such as electrochemical interfaces. The model represents the electrolyte ions as a scalar field and the solvent...
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Kształtowanie wartości wskaźników wspomagania finansowego przez przedsiębiorstwa z sektora MSP w zależności od osiąganej rentowności aktywów
PublikacjaW artykule przedstawiono różnice w sposobie kształtowania wartości wskaźników z obszaru wspomagania finansowego pomiędzy przedsiębiorstwami z sektora MSP w zależności od osiąganego przez nie poziomu rentowności aktywów. W trakcie przeprowadzonych badań uwzględniono 109 174 sprawozdania finansowe przedsiębiorstw, prowadzących działalność gospodarczą w 27 różnych działach gospodarki narodowej. Do potwierdzenia zróżnicowania wspomagania...
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Unfolding new values in the landscape of conflict
PublikacjaThe main objective of the paper is to investigate how the conflict quality of landscape can be used as its asset and potential for creating new values. Like mediation between different overlapping archaeologies offers a basis for the perception of place in the chronology of time, the mediation between conflicted areas creates a capacious zone for enhancing the unique quality of landscape in its architectural, social, cultural and...
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Binary Mixtures of Selected Bisphenols in the Environment: Their Toxicity in Relationship to Individual Constituents
PublikacjaBisphenol A (BPA) is one of the most popular and commonly used plasticizer in the industry. Over the past decade, new chemicals that belong to the bisphenol group have increasingly been used in industrial applications as alternatives to BPA. Nevertheless, information on the combined effects of bisphenol (BP) analogues is insufficient. Therefore, our current study aimed to find the biological response modulations induced by the...
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Local dynamics of fluids and dielectrics as the foundation of signal-carrying wave properties
PublikacjaThis paper develops an original approach to fundamental problems of classical linear acoustics and electromagnetics, proving a crucial role of doubly-dynamic local properties of a propagation medium in supporting wave-like fields able to carry information signals. The proof is composed of two steps concerning, subsequently, fluid acoustics and dielectric electromagnetics. The first step consists in complementing a common, practically...
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Tailoring a low-energy ball milled MnCo2O4 spinel catalyst to boost oxygen evolution reaction performance
PublikacjaThe development of cost-efficient oxygen evolution reaction (OER) catalysts is one of the most important tasks facing modern techniques for hydrogen production. In this work, for the first time, a low-energy ball milling process of MnCo2O4 (MCO) spinel powders, with a mechanical modification time exceeding 1 day was used. After 6 days of ball-milling, the obtained overpotential of the electrocatalyst reached the value of 375 mV...
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Xanthone synthetic derivatives with high anticandidal activity and positive mycostatic selectivity index values
PublikacjaWith the current massive increases in drug-resistant microbial infection as well as the significant role of fungal infections in the death toll of COVID-19, discovering new antifungals is extremely important. Natural and synthetic xanthones are promising derivatives, although only few reports have demonstrated their antifungal mechanism of action in detail. Newly synthetized by us xanthone derivative 44 exhibited strong antifungal...
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Synergisms and antagonisms between MoS2 nanotubes and representative oil additives under various contact conditions
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Talents, Competencies and Techniques of Business Analyst: A Balanced Professional Development Program
PublikacjaThis paper presents preliminary results of action research in which we search for fundamentals of an universal theory of balanced approaches to software process. It is developed on the basis of balanced approach for professional development program for business analysts which integrates approaches oriented on talents, competencies and techniques. This paper includes the description of key concepts in background approaches, components...
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Community Road Safety Strategies in the Context of Sustainable Mobility
PublikacjaThe paper presents an overview on the road safety strategies and action plans implemented in the framework of the “SOL - Save our lives: Comprehensive road safety strategy for Central Europe” project. It contains summarization of learned knowledge regarding the efficiency of measures applied and highlights examples of good practices. The purpose of the paper is to provide recommendations for effective and successful planning, formulation...