Search results for "POLE"

showing 10 items of 1981 documents

Emerging Fusarium mycotoxins in organic and conventional pasta collected in Spain

2012

Abstract One of the main sources of emerging Fusarium mycotoxins in human nutrition is the cereals and cereal products. In this study, an analytical method to determine enniatins A, A1, B and B1 (ENs), beauvericin (BEA) and fusaproliferin (FUS) based on Ultra-Turrax extraction followed by liquid chromatography coupled to triple quadrupole mass spectrometer detector (MS/MS QqQ), was applied for the analysis of pasta. For this purpose, 114 commercial samples of pasta were acquired from supermarkets located in Valencia. The results showed higher frequencies of contamination in organic pasta than in conventional pasta, while the concentration levels were variable for both types of pasta. In pos…

FusariumFood ContaminationToxicologychemistry.chemical_compoundFusariumTandem Mass SpectrometryLiquid chromatography–mass spectrometryDepsipeptidesHumansFood scienceMycotoxinOrganic AgriculturebiologyTerpenesDietary exposureReproducibility of ResultsGeneral MedicineMycotoxinsContaminationbiology.organism_classificationBeauvericinTriple quadrupole mass spectrometerHuman nutritionchemistrySpainPublic HealthEdible GrainChromatography LiquidFood ScienceFood and Chemical Toxicology
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Simultaneous determination of Fusarium mycotoxins in wheat grain from Morocco by liquid chromatography coupled to triple quadrupole mass spectrometry

2014

Abstract In the present study, eighteen (18) mycotoxin produced by the genus Fusarium (fumonisins (FB1, FB2 and FB3), type-B trichothecenes (NIV, DON, FUS-X, 3Ac-DON and 15Ac-DON), type-A trichothecenes (NEO, DAS, T2 and HT2), zearalenone (ZEA), beauvericin (BEA), and enniatins (ENA, ENA1, ENB and ENB1)) were monitored in different samples of wheat grain commercialized in Morocco. A liquid chromatography coupled to triple quadrupole mass spectrometry method previous matrix solid phase dispersion extraction was used for sample analysis. A total of eighty (80) samples of durum wheat were collected in different local markets from several areas in Morocco. Analytical results showed that 54 out …

FusariumWheat grainChromatographybiologyExtraction (chemistry)biology.organism_classificationBeauvericinMatrix (chemical analysis)chemistry.chemical_compoundchemistryTriple quadrupole mass spectrometryMycotoxinZearalenoneFood ScienceBiotechnologyFood Control
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Nuts and dried fruits: Natural occurrence of emerging Fusarium mycotoxins

2013

Abstract The occurrence of enniatins (ENs) and beauvericin (BEA) in nuts, dried fruits and dates available in Valencia (Spain) was surveyed in this study. To do this, seventy-four samples of nuts, dried fruits and dates were analyzed for the determination of mycotoxin contamination. Mycotoxins were identified and quantified using an ultrasonic-C18 extraction and LC–MS/MS with a triple quadrupole (QqQ) mass analyzer. The frequencies of contamination of nuts, shell, dried fruits and dates were 50%, 80%, 35.7% and 83.3%, respectively. Enniatin A (ENA) was the most predominant EN found in nuts (45.2%) while ENB was the most common EN found in dates (58.3%). The analytical results of the shell s…

FusariumbiologyDried fruitContaminationbiology.organism_classificationBeauvericinTriple quadrupole mass spectrometerchemistry.chemical_compoundchemistryMass analyzerFood scienceMycotoxinEnniatin AFood ScienceBiotechnologyFood Control
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Dwie drogi ze Wschodu na Zachód. Szkic biograficzny do historii polskich losów XIX i XX wieku

2020

The article was inspired by the biography of Zofia Kossak-Szczucka. The rich life of Zofia Kossak was full of extraordinary situations and twists and turns, but above all, her life was characterized by a constant journey. The road from one end of Europe – Ukraine, to the other – the British Isles. Her story became a pretext for presenting the path that two other Poles traveled from the eastern ends of Europe towards its heart and western borders. The first of them was known, although widely, but only from one chapter of the biography – Gabriel Narutowicz. An extremely interesting figure, who came to Switzerland from Lithuania for health reasons in the mid-1880s. He has found his new home in…

G. NarutowiczPolska pod zaboramiJ. BartoszewiczPoland under partitionstravels of Polespodróże Polaków
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Approche géoarchéologique sur la nécropole monumentale d'Escolives-Sainte-Camille (Yonne) : un site en bordure de chenal de l'Yonne à l'époque néolit…

2001

International audience; L'émergence du Néolithique moyen I Cerny s'accompagne dans le sud-est du Bassin parisien de l'apparition de nécropoles monumentales implantées dans les fonds de vallée fluviales. L'insertion de ces lieux funéraires dans le paysage révèle une volonté ostentatoire marquée et traduit peut-être une forme d'affirmation du groupe sur son territoire. Dans ce cadre, la fouille engagée sur la nécropole d'Escolives-Sainte-Camille "La Pièce de l'Étang" a fait l'objet de travaux spécifiques visant à caractériser l'environnement du site. ll s'agissait de restituer l'insertion de ce site bordé de deux paléochenaux dans le milieu hydrographique et d'éclairer la compréhension des co…

GRONNÉOLITHIQUE MOYEN[SHS.ARCHEO] Humanities and Social Sciences/Archaeology and Prehistory[SHS.ARCHEO]Humanities and Social Sciences/Archaeology and PrehistoryGÉOARCHÉOLOGIEPALÉOCHENALCOLLUVIONNEMENTESCOLIVES-SAINTE-CAMILLEPASSYBASSIN PARISIENCERNYNÉCROPOLE MONUMENTALEYONNE
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GUI Implementation of VCDtools, A Program to Analyze Computed Vibrational Circular Dichroism Spectra

2020

As computing power increases, vibrational circular dichroism (VCD) calculations on molecules of larger sizes and complexities become possible. At the same time, the spectra resulting from these computations become increasingly more cumbersome to analyze. Here, we describe the GUI implementation into the Amsterdam Density Functional (ADF) software package of VCDtools, a toolbox that provides a user-friendly means to analyze VCD spectra. Key features are the use of the generalized coupled oscillator analysis methods, as well as an easy visualization of the atomic electric and magnetic transition dipole moments which together provide detailed insight in the origin of the VCD intensity. Using s…

General Chemical EngineeringComputationLibrary and Information Sciences01 natural sciencesSpectral lineArticle0103 physical sciencesSDG 7 - Affordable and Clean EnergyAnalysis methodFELIX Condensed Matter PhysicsPhysics/dk/atira/pure/sustainabledevelopmentgoals/affordable_and_clean_energy010304 chemical physicsCircular DichroismStereoisomerismGeneral ChemistryKey featuresSoftware package0104 chemical sciencesComputer Science ApplicationsVisualizationComputational physics010404 medicinal & biomolecular chemistryDipoleVibrational circular dichroismSoftwareJournal of Chemical Information and Modeling
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Synthesis and X-ray Crystal Structure of New Substituted 3-4′-Bipyrazole Derivatives. Hirshfeld Analysis, DFT and NBO Studies

2021

A new compounds named 3-4′-bipyrazoles 2 and 3 were synthesized in high chemical yield from a reaction of pyran-2,4-diketone 1 with aryl hydrazines under thermal conditions in MeOH. Compound 2 was unambiguously confirmed by single-crystal X-ray analysis. It crystalizes in a triclinic crystal system and space group P-1. Its crystal structure was found to be in good agreement with the spectral characterizations. With the aid of Hirshfeld calculations, the H…H (54.8–55.3%) and H…C (28.3–29.2%) intermolecular contacts are the most dominant, while the O…H (5.8–6.5%), N…H (3.8–4.6%) and C…C (3.0–4.9%) are less dominant. The compound has a polar nature with a net dipole moment of 6.388 Debye. The …

General Chemical Engineeringpyran-24-dioneCrystal structureTriclinic crystal systemDFTInorganic Chemistrychemistry.chemical_compoundkemialliset sidoksetNBOGeneral Materials Scienceorgaaniset yhdisteetkemiallinen synteesiCrystallographyArylIntermolecular forcetiheysfunktionaaliteoriaHirshfeld analysisCondensed Matter PhysicskiteetbipyrazoleDipoleCrystallographychemistryQD901-999Intramolecular forceYield (chemistry)röntgenkristallografiaNatural bond orbitalCrystals
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X-ray Single Crystal Structure, Tautomerism Aspect, DFT, NBO, and Hirshfeld Surface Analysis of a New Schiff Bases Based on 4-Amino-5-Indol-2-yl-1,2,…

2021

Four different new Schiff basses tethered indolyl-triazole-3-thione hybrid were designed and synthesized. X-ray single crystal structure, tautomerism, DFT, NBO and Hirshfeld analysis were explored. X-ray crystallographic investigations with the aid of Hirshfeld calculations were used to analyze the molecular packing of the studied systems. The H···H, H···C, S···H, Br···C, O···H, C···C and N···H interactions are the most important in the molecular packing of 3. In case of 4, the S···H, N···H, S···C and C···C contacts are the most significant. The results obtained from the DFT calculations indicated that the thione tautomer is energetically lower than the thiol one by 13.9545 and 13.7464 kcal…

General Chemical Engineeringtautomerism aspectInorganic Chemistrysymbols.namesakeGeneral Materials SciencetyppiyhdisteetDebyechemistry.chemical_classificationkemiallinen synteesiCrystallographyX-rayCondensed Matter Physicsindolyl-triazole-3-thioneTautomerSchiff bases; indolyl-triazole-3-thione; tautomerism aspect; Hirshfeld Surface AnalysisCrystallographyDipolechemistryQD901-999Thiolsymbols1 2 4 triazole 3 thioneSchiff basesHirshfeld Surface AnalysisSingle crystaltautomeriaNatural bond orbitalCrystals; Volume 11; Issue 9; Pages: 1041
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Can aromaticity be connected with molecular polarizability? A theoretical study of benzene isomers and five-membered heterocyclic molecules

2004

Extended calculations of molecular electric dipole polarizability tensor, at Hartree-Fock and correlated level of accuracy (MP2, CCS, CC2, CCSD, and CCSD(T)) have been carried out to investigate whether aromaticity could be related to the electric dipole polarizability of planar ring systems. The calculations prove the exaltation of the average property of conjugated molecules, which is possibly due to their easily polarizable π-electron cloud. On the other hand, theoretical out-of-plane polarizability components are smaller in benzene than in any other C$_6$H$_6$ isomer. The aromatic stabilization energies of monosubstituted five-membered conjugated cyclic molecules increase in the same di…

General EngineeringAromaticityaromaticityfive-membered heterocyclic moleculesConjugated systemRing (chemistry)Polarizability tensorpolarizabilityComputer Science ApplicationsComputational Mathematicschemistry.chemical_compoundDipolechemistryPolarizabilityComputational chemistryPhysics::Atomic and Molecular ClustersMoleculePhysics::Atomic PhysicsPhysics::Chemical Physicsaromaticity; polarizability; five-membered heterocyclic molecules.Benzene
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The role of rock mining for maintaining Dauco carotae-Crepidetum rhoeadifoliae Hejný et Grüll in Hejný et al. 1979 — a new to Poland plant association

2013

AbstractThis work presents the Dauco carotae-Crepidetum rhoeadifoliae plant association, which is new to Poland. The association has been observed in industrial reclamation areas in the vicinity of carbonate mineral excavation sites in the central part of the Opole region. In the vast majority of cases, plots of this association developed in reclaimed areas. The majority of diagnostic species for the association was found within surveyed plots, including Verbascum thapsus, V. densiflorum and Bryum argenteum. Taxa characteristic of the alliance were also constantly present, i.e. Daucus carota, Melilotus alba, M. officinalis, Echium vulgare and Erysimum hieracifolium. This association belongs…

General Immunology and MicrobiologyQH301-705.5Ecologyplant communityGeneral NeuroscienceRare speciesPlant communityBiologybiology.organism_classificationEchium vulgareGeneral Biochemistry Genetics and Molecular Biologysw polandCrepisTaxonvegetation ecologyopole silesiaVerbascum thapsusBotanyCrepis foetidaRuderal speciescrepis foetidaasteraceaeBiology (General)General Agricultural and Biological Sciencesrare speciesOpen Life Sciences
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