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Search results for: KOŚCIÓŁ CYSTERSKI
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Experimental and Theoretical Insights into the Intermolecular Interactions in Saturated Systems of Dapsone in Conventional and Deep Eutectic Solvents
PublicationSolubility is not only a crucial physicochemical property for laboratory practice but also provides valuable insight into the mechanism of saturated system organization, as a measure of the interplay between various intermolecular interactions. The importance of these data cannot be overstated, particularly when dealing with active pharmaceutical ingredients (APIs), such as dapsone. It is a commonly used anti-inflammatory and...
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The Importance of Contextual Topology in the Process of Harmonization of the Spatial Databases on Example BDOT500
PublicationIn this work, we present two detailed problems of topological errors in spatial database. Both issues are inconsistencies in the database, i.e. interior topological relationships layers of buildings and the relationship between the buildings layer and the layer of plots. That inconsistency is related to the residual polygons that arise as a result of overlapping objects, or gaps between objects. The occurrence of this type of error...
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Ekonomična efektivnist` teplovoï pompi v sistemi opalennâ = Economical efficiency of heat pump system in heating system
PublicationW artykule opisano wynik porównawczych obliczeń kosztów ogrzewania budynku jednorodzinnego. Porównano koszty konwencjonalnego ogrzewania z kotłem olejowym jako źródłem ciepła z kosztami ogrzewania układem hybrydowym, w którym współpracują ze sobą dwa żródła ciepła: konwencjonalny kocioł olejowy i sprężarkowa pompa ciepła. Wykonano studium parametryczne kosztów ogrzewania z wykorzystaniem metody kosztów narastających.
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Rafał Hein dr hab. inż.
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O możliwości upraszczania obliczeń na wstępnych etapach projektowania elektrowni statków towarowych
PublicationW referacie przedstawiono uproszczoną metodę określania zapotrzebowania na energię elektryczną w określonych stanach eksploatacji statków towarowych, celem doboru wiel-kości i ilości `źródeł energii elektrycznej. Metoda może być stosowana na wstępnych eta-pach projektowania siłowni okrętowych.
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Variational approach for interacting ultra-cold atoms in arbitrary one-dimensional confinement
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Determination of resonances by the optimized spectral approach
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Doubly Excited Resonance States of Helium Atom: Complex Entropies
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Capturing nonexponential dynamics in the presence of two decay channels
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Pale wkręcane ATLAS
PublicationPrzedstawiono praktyczne zastosowanie nowoczesnych, przemieszczeniowych pali wkręcanych typu ATLAS. Omówiono zasady obliczeń tego rodzaju pali, również na podstawie wyników badań sondą CPT. Przykłady posadowień z terenu Polski pozwalają na ocenę mozliwości posadowień w warunkach krajowych.
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Pale wkręcane ATLAS
PublicationOmówiono nową technologię pali ATLAS. Przedstawiono przykłady zastosowania w odniesieniu do gruntów silnie uwarstwionych. Przedyskutowano metody obliczeń.
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#CiekawiNauki – Fascynujące życie zabytków
EventsPolitechnika Otwarta zaprasza na 8. spotkanie z cyklu #CiekawiNauki. Tematem będą gdańskie zabytki.
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Oliwia Kozioł
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Color prediction from first principle quantum chemistry computations: a case of alizarin dissolved in methanol
PublicationThe electronic spectrum of alizarin (AZ) in methanol solution was measured and used as reference data for color prediction. The visible part of the spectrum was modelled by different DFT functionals within the TD-DFT framework. The results of a broad range of functionals applied for theoretical spectrum prediction were compared against experimental data by a direct color comparison. The tristimulus model of color expressed in terms...
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Exploring the cocrystallization potential of urea and benzamide
PublicationThe cocrystallization landscape of benzamide and urea interacting with aliphatic and aromatic carboxylic acids was studied both experimentally and theoretically. Ten new cocrystals of benzamide were synthesized using an oriented samples approach via a fast dropped evaporation technique. Information about types of known bi-component cocrystals augmented with knowledge of simple binary eutectic mixtures was used for the analysis...
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Applicability of phenolic acids as effective enhancers of cocrystals solubility of methylxanthines
PublicationApplicability of phenolic acids as potential cocrystal formers for methylxanthine derivatives was analyzed both in terms of cocrystallization probabilities and solubility advantage. The cocrystal formation abilities were evaluated using mixing enthalpy estimated within the conductor like screening model for real solvents (COSMO-RS) framework. The solubility improvement of potential cocrystals was estimated by formulation of the...
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Propensity of salicylamide and ethenzamide cocrystallization with aromatic carboxylic acids
PublicationThe cocrystallization of salicylamide (2-hydroxybenzamide, SMD) and ethenzamide (2-ethoxybenzamide, EMD) with aromatic carboxylic acids was examined both experimentally and theoretically. The supramolecular synthesis taking advantage of the droplet evaporative crystallization (DEC) technique was combined with powder diffraction and vibrational spectroscopy as the analytical tools. This led to identification of eleven new cocrystals...
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Thermodynamics and Intermolecular Interactions of Nicotinamide in Neat and Binary Solutions: Experimental Measurements and COSMO-RS Concentration Dependent Reactions Investigations
PublicationIn this study, the temperature-dependent solubility of nicotinamide (niacin) was measured in six neat solvents and five aqueous-organic binary mixtures (methanol, 1,4-dioxane, acetonitrile, DMSO and DMF). It was discovered that the selected set of organic solvents offer all sorts of solvent effects, including co-solvent, synergistic, and anti-solvent features, enabling flexible tuning of niacin solubility. In addition, differential...
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Solvent Screening for Solubility Enhancement of Theophylline in Neat, Binary and Ternary NADES Solvents: New Measurements and Ensemble Machine Learning
PublicationTheophylline, a typical representative of active pharmaceutical ingredients, was selected to study the characteristics of experimental and theoretical solubility measured at 25 °C in a broad range of solvents, including neat, binary mixtures and ternary natural deep eutectics (NADES) prepared with choline chloride, polyols and water. There was a strong synergistic effect of organic solvents mixed with water, and among the experimentally...
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Solubility of dapsone in deep eutectic solvents: Experimental analysis, molecular insights and machine learning predictions
PublicationBackground. Dapsone (DAP) is an anti-inflammatory and antimicrobial active pharmaceutical ingredient used to treat, e.g., AIDS-related diseases. However, low solubility is a feature hampering its efficient use. Objectives. First, deep eutectic solvents...
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New Screening Protocol for Effective Green Solvents Selection of Benzamide, Salicylamide and Ethenzamide
PublicationNew protocol for screening efficient and environmentally friendly solvents was proposed and experimentally verified. The guidance for solvent selection comes from computed solubility via COSMO-RS approach. Furthermore, solute-solvent affinities computed using advanced quantum chemistry level were used as a rationale for observed solvents ranking. The screening protocol pointed out that 4-formylomorpholine (4FM) is an attractive...
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Building a heterogeneous network of digital libraries on the Semantic Web
PublicationBiblioteki dążą do skupiania się w grupy, które poza lokalnym wyszukiwaniem pozwalają na wyszukiwanie zasobów w pozostałych bibliotekach cyfrowych. Jednakże różne typy użytkowników zapoczątkowały różne rodzaje bibliotek. W niniejszym artykule przedstawiamy jak obecnie odbywa się komunikacja między bibliotekami cyfrowymi. Prezentujemy również w jaki sposób technologie Semantic Web mogą pomóc w rozwiązaniu problemów heterogenicznych...
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Petrographic, mineralogical, and climatic analyses, and risk maps for conservation strategies
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Superimposed ice as nutrient storage
PublicationNutrient cycling in the glacial environment is known from the perspective of meltwater release and snowpack elution processes, but the superimposed ice temporary storage remains poorly understood. In this study, the enrichment of superimposed ice in nutrient ions: nitrite, nitrate and ammonium was studied in more detail. The release of these ions from superimposed ice into a supraglacial stream was considered also, additionally...
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Hydrophobic and hydrophilic properties of pollutants as a factor influencing their redistribution during snowpack melt
PublicationGlaciers accumulate organic pollutants delivered by snow. However, our understanding of the exact dynamics of organic pollutants in the snowpack relies primarily on laboratory experiments and mathematical models. To fill the gap related to the detailed field data, we have conducted observations of melting snow profiles in two locations and three different stages of melting on one High Arctic glacier, as well as in superimposed...
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An Algorithm for Optimizing the Determination of Cycling Routes on the Example of the Gdansk Agglomeration
PublicationPhysical activity is an essential part of a healthy lifestyle. One of the manifestations of the change in a society type from consumer to information one is the understanding of the importance of ecology and a healthy lifestyle. This is evident, inter alia, in the inventiveness and involvement of the society in the start-up and solutions referred to as the Smart City. One example is the development of e-bike rental and local investments...
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Chemical hazard in glacial melt? The glacial system as a secondary source of POPs (in the Northern Hemisphere). A systematic review
PublicationToxicity of compounds belonging to persistent organic pollutants (POPs) iswidely known, and their re-emission from glaciers has been conclusively demonstrated. However, the harmful effects associated with such secondary emissions have yet to be thoroughly understood, especially in the spatial and temporal context, as the existing literature has a clear sampling biaswith the best recognition of sites in the European Alps. In this...
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Badanie korelacji efektu emisji magnetoakustycznej ze zmianami mikrostruk- tury stali 10H2M. Zesz. Probl. - Badania Nieniszczące.**2003 nr 8 s. 67-70, 5 rys. bibliogr. 5 poz. Materiały 32 Krajowej Konferencji Badań Nieniszczących 32 KKBN. Międzyzdro-je 28-30. X. 2003 r.
PublicationPrzedstawiono wyniki badania korelacji efektu emisji magnetoakustycznej zezmianami mikrostruktury stali 10H2M w trakcie procesu degradacji. Rozwójkształtu i koncentracji wydzieleń wewnątrz ziarna i na granicy ziaren badanoanalizując obrazy mikrostruktury z mikroskopu skaningowego. Wykazano, że za-nik natężenia emisji magnetoakustycznej jest skorelowany ze wzrostem szero-kości wydzieleń na granicy ziaren ferrytu.
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Mikrosiłownia domowa jako źródło energii cieplnej i elektrycznej
PublicationNa Forum Energetyków zaprezentowano pierwsze w Polsce stanowisko parowej mikrosiłowni domowej ORC z kotłem gazowym jako samodzielnym źródłem ciepła. W przeprowadzonych badaniach eksperymentalnych wykazano możliwość kogeneracyjnej produkcji energii cieplnej i elektrycznej w aspekcie częściowego pokrycia potrzeb gospodarstwa domowego. Domowy kocioł gazowy doposażony w moduł parowy z alkoholem etylowym jako czynnikiem roboczym zasługuje...
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NFOŚiGW The Church towards Ecological Crisis. On the 30th Anniversary of Polish Bishops’ Pastoral Letter on Environmental Protection
ProjectsProject realized in Cardinal Stefan Wyszynski University in Warsaw according to 94/2019/Wn50/EE-se/D agreement from 2019-03-26
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Wiktor Sieklicki dr inż.
PeopleMechanical Engineer degree in Automatics and Robotics achieved in 2006 from Mechanical Faculty of Gdansk University of Technology, Mechanics and Strength of the Materials Department (thesis topic: "Micro electro-mechanical devices for laparoscopy"). Thesis written during the exchange program with Genova University, Italy. PhD in Mechatronics finished in 2010 from Mechanical Faculty of Gdansk University of Technology, Mechanics...
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Modelowanie 3D zabytkowego obiektu sakralnego za pomocą stacjonarnego skaningu laserowego na podstawie analizy światła naturalnego
PublicationTechnologia skanowania laserowego jest powszechnie stosowana w inwentaryzacji obiektów kultury. Ciągły wzrost technologiczny pozwala na wykorzystanie złożonych modeli cyfrowych 3D przez coraz większą liczbę odbiorców. Jedną z odmian zastosowania modeli jest tzw. HBIM (HistoricalBIM/ HeritageBIM). W artykule skupiliśmy się na pierwszym z etapów zarządzania takim projektem, jak inwentaryzacja. Celem pracy jest określenie przydatności...
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Przykłady zastosowań
PublicationW rozdziale przedstawiono przykładowy sposób analizy funkcji systemów sterowania i zabezpieczeń w odniesieniu do turbozespołu o strukturze typu: kocioł-turbina-generator. Ryzyko związane z eksploatacją turbozespołu zależy od różnych czynników i rozwiązań technicznych, organizacyjnych oraz od zastosowanych podsystemów sterowania, zabezpieczeń oraz systemów E/E/PE związanych z bezpieczeństwem. Jednym z elementów takiego podsystemu...
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Witold Zbirohowski-Kościa mgr
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Marek Kościuk
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On the origin of surface imposed anisotropic growth of salicylic and acetylsalicylic acids crystals during droplet evaporation
PublicationIn this paper droplet evaporative crystallization of salicylic acid (SA) and acetylsalicylic acid (ASA) crystals on different surfaces, such as glass, polyvinyl alcohol (PVA), and paraffin was studied. The obtained crystals were analyzed using powder X-ray diffraction (PXRD) technique. In order to better understand the effect of the surface on evaporative crystallization, crystals deposited on glass were scraped off. Moreover,...
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Experimental and theoretical solubility advantage screening of bi-component solid curcumin formulations
PublicationA comprehensive experimental and theoretical screening was performed for identification of curcumin solubilizers. Experimental data led to formulation of a non-linear QSPR model correlating molecular descriptors with measured solubilities. The majority of synthesized binary systems exhibited a moderate enhancement of curcumin solubility, which was found to be the highest in the case of curcumin cocrystallized with pyrogallol. New...
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On the origin of surfaces-dependent growth of benzoic acid crystal inferred through the droplet evaporation method
PublicationCrystal growth behavior of benzoic acid crystals on different surfaces was examined. The performed experiments documented the existence of very strong influence introduced by polar surfaces as glass, gelatin, and polyvinyl alcohol (PVA) on the growth of benzoic acid crystals. These surfaces impose strong orientation effect resulting in a dramatic reduction of number of faces seen with x-ray powder diffractions (XPRD). However,...
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Utilization of oriented crystal growth for screening of aromatic carboxylic acids cocrystallization with urea
PublicationThe possibility of molecular complex formation in the solid state of urea with benzoic acid analogues was measured directly on the crystallite films deposited on the glass surface using powder X-ray diffractometry (PXRD). Obtained solid mixtures were also analyzed using Fourier transform infrared spectroscopy (FTIR). The simple droplet evaporation method was found to be efficient, robust, fast and cost-preserving approach for first...
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On the origin of surfaces-dependent growth of benzoic acid crystal inferred through the droplet evaporation method
PublicationCrystal growth behavior of benzoic acid crystals on different surfaces was examined. The performed experiments documented the existence of very strong influence introduced by polar surfaces as glass, gelatin, and polyvinyl alcohol (PVA) on the growth of benzoic acid crystals. These surfaces impose strong orientation effect resulting in a dramatic reduction of number of faces seen with x-ray powder diffractions (XPRD). However,...
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On the origin of surfaces-dependent growth of benzoic acid crystal inferred through the droplet evaporation method
PublicationCrystal growth behavior of benzoic acid crystals on different surfaces was examined. The performed experiments documented the existence of very strong influence introduced by polar surfaces as glass, gelatin, and polyvinyl alcohol (PVA) on the growth of benzoic acid crystals. These surfaces impose strong orientation effect resulting in a dramatic reduction of number of faces seen with x-ray powder diffractions (XPRD). However,...
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Solubility of sulfanilamide in binary solvents containing water: Measurements and prediction using Buchowski-Ksiazczak solubility model
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Studies on the solid-liquid equilibria and intermolecular interactions Urea binary mixtures with Sulfanilamide and Sulfacetamide
PublicationThe binary phase diagrams of Sulfanilamide-Urea (SN-U) and Sulfacetamide-Urea (SC-U) were measured using differential scanning calorimetry technique (DSC). Both examined mixtures were found to form simple binary eutectics. The limited miscibility in the solid state observed by DSC, proving inability of co-crystallization in new multi-molecular form, was also confirmed using PXRD and FTIR-ATR measurements of solid dispersions...
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Experimental and theoretical studies on the Sulfamethazine-Urea and Sulfamethizole-Urea solid-liquid equilibria
PublicationThe miscibility of active pharmaceutical ingredients with excipients is an important aspect in pharmaceutical technology protocols. In this study, the differential scanning calorimetry (DSC) was used for Sulfamethazine-Urea (SI–U) and Sulfamethizole-Urea (SO–U) solid-liquid phase diagrams determination. Both sulfonamides form simple binary eutectics with Urea. The lack of new co-crystal phase formation was confirmed by inspection...
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Thermodynamic Characteristics of Phenacetin in Solid State and Saturated Solutions in Several Neat and Binary Solvents
PublicationThe thermodynamic properties of phenacetin in solid state and in saturated conditions in neat and binary solvents were characterized based on differential scanning calorimetry and spectroscopic solubility measurements. The temperature-related heat capacity values measured for both the solid and melt states were provided and used for precise determination of the values for ideal solubility, fusion thermodynamic functions, and...
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Collagen Type II—Chitosan Interactions as Dependent on Hydroxylation and Acetylation Inferred from Molecular Dynamics Simulations
PublicationChitosan–collagen blends have been widely applied in tissue engineering, joints diseases treatment, and many other biomedical fields. Understanding the affinity between chitosan and collagen type II is particularly relevant in the context of mechanical properties modulation, which is closely associated with designing biomaterials suitable for cartilage and synovial fluid regeneration. However, many structural features influence...
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Solubility Characteristics of Acetaminophen and Phenacetin in Binary Mixtures of Aqueous Organic Solvents: Experimental and Deep Machine Learning Screening of Green Dissolution Media
PublicationThe solubility of active pharmaceutical ingredients is a mandatory physicochemical characteristic in pharmaceutical practice. However, the number of potential solvents and their mixtures prevents direct measurements of all possible combinations for finding environmentally friendly, operational and cost-effective solubilizers. That is why support from theoretical screening seems to be valuable. Here, a collection of acetaminophen...
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Exploring the Solubility Limits of Edaravone in Neat Solvents and Binary Mixtures: Experimental and Machine Learning Study
PublicationThis study explores the edaravone solubility space encompassing both neat and binary dissolution media. Efforts were made to reveal the inherent concentration limits of common pure and mixed solvents. For this purpose, the published solubility data of the title drug were scrupulously inspected and cured, which made the dataset consistent and coherent. However, the lack of some important types of solvents in the collection called...
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Deep Eutectic Solvents as Agents for Improving the Solubility of Edaravone: Experimental and Theoretical Considerations
PublicationIn this study, both practical and theoretical aspects of the solubility of edaravone (EDA) in Deep Eutectic Solvents (DESs) were considered. The solubility of edaravone in some media, including water, can be limited, which creates the need for new efficient and environmentally safe solvents. The solubility of EDA was measured spectrophotometrically and the complex intermolecular interactions within the systems were studied with...
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Deep Eutectic Solvents as Agents for Improving the Solubility of Edaravone: Experimental and Theoretical Considerations
PublicationIn this study, both practical and theoretical aspects of the solubility of edaravone (EDA) in Deep Eutectic Solvents (DESs) were considered. The solubility of edaravone in some media, including water, can be limited, which creates the need for new efficient and environmentally safe solvents. The solubility of EDA was measured spectrophotometrically and the complex intermolecular interactions within the systems were studied with...