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Search results for: STRUKTURA ENZYMU
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Effects of Coulomb interaction on the electronic structure and lattice dynamics of the Mott insulatorFe2SiO4spinel
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Poly(vinyl alcohol)/GO-MMT nanocomposites: Preparation, structure and properties
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Enhancement of the structure stability of MOF‐5 confined to multiwalled carbon nanotubes
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Structural Determinants of Substrate Specificity of SplF Protease from Staphylococcus aureus
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Structure and elastic properties of Mg(OH)2from density functional theory
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Structure and wettability of heterogeneous monomolecular films of phospholipids with cholesterol or lauryl gallate
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Pincer Complexes Based on Phosphinoaminopyridines: Synthesis, Structural Characterization and Catalytic Applications
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The Effects of Silver Ion Implantation on Structural and Morphological Performance of Hydroxyapatite Coatings
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Deltorphin analogs restricted via a urea bridge: structure and opioid activity
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Simulation of Protein Structure and Dynamics with the Coarse-Grained UNRES Force Field
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Structural Model of the Bilitranslocase Transmembrane Domain Supported by NMR and FRET Data
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Deltorphin analogs restricted via a urea bridge: structure and opioid activity
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Conformation-family Monte Carlo: A new method for crystal structure prediction
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Optimal Shape Refurbishment of Distorted Dome Structure with Safeguarding of Member Stress
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Structural, thermal and photocatalytic properties of composite materials SiO2/TiO2/C
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Azomacrocyclic derivatives of imidazole: synthesis, structure, and metal ion complexation properties
PublicationNew azocrown ethers comprising imidazoles in the macrocycle have been synthesized. Imidazole, 2-methyl-, 4-methyl-, and 4-phenylimidazole were incorporated to form macrocyclic units by coupling with the appropriate bis-diazonium salts. The syntheseswere performed under high dilution conditions. The X-ray structure of a water adduct of the 21-membered crown ether derivative of 4-methylimidazole 8 has been solved. Metal...
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Lamb Wave Based Structural Damage Detection Using Stationarity Tests
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Structure – chiroptical properties relationship of cisoid enones with an α-methylenecyclopentanone unit
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Synthesis and comprehensive structural and physicochemical characterization of dutasteride hydrochloride hydrate solvates
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Analysis of molecular structure of starch citrate obtained by a well-stablished method
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Structural properties and adsorption of uranyl ions on the nanocomposite hydroxyapatite/white clay
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The role of intermolecular interactions in stabilizing the structure of the nematic twist-bend phase
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Analysis of the amount of retained austenite in the structure of steel rolls for sheet rolling
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Influence of TiO2 structure on its photocatalytic activity towards acetaldehyde decomposition
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Minimal parameter implicit solvent model for ab initioelectronic-structure calculations
PublicationAbstract - We present an implicit solvent model for ab initio electronic-structure calculations which is fully self-consistent and is based on direct solution of the nonhomogeneous Poisson equation. The solute cavity is naturally defined in terms of an isosurface of the electronic density according to the formula of Fattebert and Gygi (J. Comput. Chem., 23 (2002) 662). While this model depends on only two parameters, we demonstrate...
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Molecular and structural characteristics of cod gelatin films modifiedwith EDC and TGase
PublicationCod gelatin films before and after cross-linking of gelatin with 1-ethyl-3-(3-dimethylaminopropyl) carbodiimide (EDC) or transglutaminase (TGase) have been characterized by FT-IR spectroscopy and DSC analysis. For comparison, a film prepared from unmodified pig gelatin has been also analysed. The difference spectra showed that cod gelatin during the film formation involved first of all water-to-amide hydrogen bonds, and the film...
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Structure elucidation of carbamoylo-β-lactam diastereoisomers by ROESY and NOESY experiments
PublicationRecently we have focused in the problem of preparation of carbamoylo-β-lactams as a result of oxidative cyclization of malonyl enamides. In our experiments we obtain mixture of two main β-lactam products: as a result of subsequent elimination and a second as a product of substitution. All of the produced β-lactams have trans configuration what was confirmed by 1H coupling constants. However id should be stressed that in the case...
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Structure of sol-gel derived Nb2O5 films for active coating devices
PublicationW artykule przedstawiono wyniki badań struktury cienkich warstw nb2o5 otrzymywanych metodą zol-żel. wytworzone warstwy charakteryzowano pod kątem zastosowania jako materiałów na aktywne pokrycia fotoniczne.
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Influence of electric power generator structure on frequency control - mathematical modeliling
PublicationPodstawowym celem pakietu ''3x20'' Unii Europejskiej jest zmniejszenie o 20% emisji dwutlenku węgla. Z tego powodu oczekuje się w Polsce rozwoju energetyki wiatrowej, podobnie jak energetyki jądrowej, a także mini elektrociepłowni. Elektrownie wiatrowe i jądrowe wnoszą specyficzne problemy w regulacji automatycznej częstotliwości systemu elektroenergetycznego. farmy wiatrowe wymagają pod tym względem wspomagania przez elektrownie...
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Road Safety Observatories within the Structure of Integrated Transport Safety Systems
PublicationAccurate knowledge about the causes, circumstances and place of transport accidents is the prerequisite to take the correct action to improve transport safety. Developing appropriate organizational structures, forms and methods of management and implementation of safety measures in the sectoral approach condition the success. Therefore the Safety Information System is one of the integral areas of the Integrated Transport Safety...
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Urban Development Strategies in Times of Structural Changes - Lessons from Poland
PublicationPraca obejmuje skrótowa prezentację współczesnych procesów rozwoju i transformacji polskich miast ze szczególnym uwzględnieniem zmian wynikających z transformacji ustrojowej.
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The impact of technological and structural changes in the national economy on the labour-capital relations
PublicationThe aim of the research presented in this paper is to present the relations between labour and capital in the national economy, resulting from technological and structural changes taking place in the years 1991 to 2008. The structure of the paper is as follows. It first presents the functional determinants for the Polish economy in 1991-2008 affecting the phenomenon subject to study. Then it presents the preliminary analysis of...
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Preparation and structure of nanocrystalline sol-gel derived lithium titanate powder
Publicationw pracy szczegółowo opisano nowatorską metodę wytwarzania nanokrystalicznych proszków tytanianu litu. przedstawiono wyniki badań wykonanych próbek.
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Structure and Molecular Dynamics in Renewable Polyamides from Dideoxy-Diamino Isohexide
PublicationThe chemical structure, the conformation, andthe flexibility of the polymer chain fragments present in thepolyamides synthesized from 2,5-diamino-2,5-dideoxy-1,4;3,6-dianhydrosorbitol, 1,4-diaminobutane, and either sebacic orbrassylic acid have been studied by liquid-state 2D NMRspectroscopy viz. correlation spectra (COSY) and heteronuclearmultiple-bond correlation spectra (gHMBC), by 13Ccross-polarization/magic-angle spinning...
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Structural properties of hydration shell around various conformations of simple polypeptides
PublicationIn this paper we investigate structural properties of water within the solvation shell around the peptide core created by a well-defined conformation of polypeptide chain. The following secondary structures are investigated: linear (straight chain), and three helices PII (polyproline-like), 310, and α. We propose using the two-particle contribution to entropy as a rational measure of the water structural ordering within the solvation...
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Processing data on sea bottom structure obtained by means of the parametric sounding
PublicationThe aim of the paper is to analyze data obtain during sounding of the Gdansk Bay by means of the parametric sonar. The accuracy of the sea bottom structure investigation needs the correct configuration of research equipment and the proper calibration of peripheral devices (GPS, heading sensor, motion sensor MRU-Z and navigation units) which provide necessary data to bathymetrical measurement system enabling its work with whole...
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Linear viscoelastic modelling of damage-involved structural pounding during earthquakes
PublicationDamage-involved structural pounding during earthquakes has been recently intensively studied using different impact force models. The results of the previous studies indicate that the linear viscoelastic model is relatively simple yet accurate in modelling pounding-involved behaviour of structures during earthquakes. The only shortcoming of the model is a negative value of the pounding force occurring just before separation, which...
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Electronic structure of PrBa2Cu3O7 after high-pressure compressionfrom first principles
PublicationW pracy zbadano wpływ ściskania wysokociśnieniowego (P=9GPa) na elektronową strukturę pasmową, rozkład ładunku i momenty magnetyczne w pełni utlenionego stechiometrycznego układu PrBa2Cu3O7. Zaobserwowano następujące zmiany wywołane ściskaniem: (1) zmniejszoną gęstość stanów (DOS) na poziomie Fermiego Ef, (2) zwiększona różnicę pomiędzy wartościami DOS dla stanów "spin-up" i "spin-down" w najbliższym otoczeniu Ef, (3) zmniejszone...
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Optymalizacja mikrofalowego generatora plazmy o strukturze współosiowej zasilanego falowodem
PublicationW niniejszym artykule przedstawiono wyniki optymalizacji transferu energii w mikrofalowym generatorze plazmy o strukturze współosiowej zasilanym falowodem WR 340. Do obliczeń posłużono się programem Comsol Multiphysics. Dla zwartego odcinka linii współosiowej o optymalnej długości 52 mm, minimalny stosunek mocy fali odbitej do mocy fali padającej mierzony w płaszczyźnie wejściowej prezentowanego generatora plazmy zmniejszył się...
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Application of the fluid–structure interaction technique for the analysis of hydrodynamic lubrication problems.
PublicationFluid–structure interaction technique seems to be one of the most promising possibilities for theoretical analysis of lubrication problems. It allows coupling of different physical fields in one computational task, taking into account the interaction between them. In this article, two sets of fluid–structure interaction analyses focusing on the bearing performance evaluation are presented. One analysis was applied to a water-lubricated...
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Experimental and numerical evaluation of mechanical behaviour of composite structural insulated panels
PublicationComposite structural insulated panels (CSIPs) are novel prefabricated elements for structural applications. Panels under consideration are made from glass-fibre reinforced magnesia cement boards as facesheets and expanded polystyrene foam (EPS) as a core. Quasi-static full-scale and model bending tests under monotonic loading were performed to recognize mechanical properties of CSIPs in flexure. In addition, tensile, compressive,...
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Economic growth, structural change and quality upgrading in New Member States
PublicationThe purpose of this research is to present the recent developments concerning structural change and productivity growth in New Member States and the role played in such process by country specific factors. We focus on ten countries (NMS-10) which joined the EU in 2004 and analyze productivity dynamics of their labor structures between the years 1995 and 2005 in a comparative setting versus EU-15 economies. NMS-10 have gone through...
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Propagation of guided elastic waves in shell-type aircraft structural elements
PublicationW pracy przedstawiony powłokowy spektralny element skończony do analizy zjawiska propagacji fal sprężystych w elementach konstrukcyjnych typu powłokowego.
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Propagation of elastic waves in structural elements by spectral finite element methods
PublicationW pracy przedstawiono metodę elementów spektralnych w zastosowaniu do analizy propagacji fal sprężystych w elementach konstrukcyjnych.
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Simulation of damage process of containership's side structure due to collision with a rock
PublicationW artykule przedstawiono wyniki uproszczonego modelowania numerycznego procesu kolizji burty kontenerowca ze skałą. Analiza wyników modelowania pozwala wyciągnąć wnioski o charakterze zjawiska jak również określić obszar i głębokość uszkodzenia wywołanego przez penetrującą skałę w celu doboru wymiarów geometrii i wypełniacza dla drugiej bariery ochronnej.
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Acetylcholinesterase inhibitors: structure-activity relationship and kinetic studies on selected flavonoids
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PbGa2GeS6 crystal as a novel nonlinear optical material: Band structure aspects
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Two-phase flow structure assessment based on dynamic image analysis
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FPGA Implementation of the Gradient Adaptive Lattice Filter Structure for Feature Extraction
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Plasmon and structure resonances in the scattering of light by a periodic chain of silver nanocylinders
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