Search results for "ddc:5"

showing 10 items of 1717 documents

Rapid hyperpolarization and purification of the metabolite fumarate in aqueous solution

2020

Significance Magnetic resonance imaging is hindered by inherently low sensitivity, which limits the method for the most part to observing water molecules in the body. Hyperpolarized molecules exhibit strongly enhanced MRI signals which opens the door for imaging low-concentration species in vivo. Biomolecules can be hyperpolarized and injected into a patient allowing for metabolism to be tracked in real time, greatly expanding the information available to the radiologist. Parahydrogen-induced polarization (PHIP) is a hyperpolarization method renowned for its low cost and accessibility, but is generally limited by low polarization levels, modest molecular concentrations, and contamination by…

Molar concentrationparahydrogen02 engineering and technologyBiosensing Techniques010402 general chemistry01 natural sciencesChemical reaction41003 medical and health sciences0302 clinical medicineFumaratesHyperpolarization (physics)Carbon-13 Magnetic Resonance SpectroscopyPolarization (electrochemistry)DissolutionhyperpolarizationBiomarker; Hyperpolarization; Metabolism; MRI; Parahydrogen; Fumarates; Molecular Imaging; Solutions; Water; Biosensing Techniques; Carbon-13 Magnetic Resonance Spectroscopychemistry.chemical_classificationParahydrogenMultidisciplinaryAqueous solutionChemistryBiomolecule500WaterBiomarker021001 nanoscience & nanotechnologyCombinatorial chemistryMolecular Imaging0104 chemical sciencesSolutionsSolventChemistryHyperpolarizationMetabolism030220 oncology & carcinogenesisReagentPhysical Sciencesbiomarkerddc:5000210 nano-technologymetabolismBiosensorMRI
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Deciphering the Rules Underlying Xenogeneic Silencing and Counter-Silencing of Lsr2-like Proteins Using CgpS of Corynebacterium glutamicum as a Model

2020

In actinobacteria, Lsr2-like nucleoid-associated proteins function as xenogeneic silencers (XS) of horizontally acquired genomic regions, including viral elements, virulence gene clusters in Mycobacterium tuberculosis, and genes involved in cryptic specialized metabolism in Streptomyces species. Consequently, a detailed mechanistic understanding of Lsr2 binding in vivo is relevant as a potential drug target and for the identification of novel bioactive compounds. Here, we followed an in vivo approach to investigate the rules underlying xenogeneic silencing and counter-silencing of the Lsr2-like XS CgpS from Corynebacterium glutamicum. Our results demonstrated that CgpS distinguishes between…

Molecular Biology and PhysiologyGene Transfer HorizontalactinobacteriaMicrobiologyQR1-502Corynebacterium glutamicumDNA-Binding Proteinsregulatory networksBacterial Proteinslsr2ddc:570xenogeneic silencinghorizontal gene transferGene Silencingcounter-silencingat-rich dnaProtein BindingTranscription FactorsResearch ArticlemBio
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Local structure and dynamics of wurtzite‐type ZnO from simulation‐based EXAFS analysis

2014

Conventional methods of EXAFS data analysis are often limited to the nearest coordination shells of the absorbing atom due to the difficulties in accurate accounting for the so-called multiple-scattering effects. Besides, it is often difficult to resolve the non-equivalent groups of atoms in a single coordination shell due to strong correlation between structural parameters. In this study we overcome these problems by applying two different simulation-based methods, i.e., classical molecular dynamics (MD) and reverse Monte with evolutionary algorithm (EA), to the analysis of the Zn K-edge EXAFS data for wurtzite-type bulk ZnO. The RMC/EA-EXAFS method allowed us to separate the contributions…

Molecular dynamicsCrystallographyNanostructureExtended X-ray absorption fine structureChemical physicsChemistryThermalAtomShell (structure)ddc:530Reverse Monte CarloCondensed Matter PhysicsWurtzite crystal structurephysica status solidi c
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Electroburning of few-layer graphene flakes, epitaxial graphene, and turbostratic graphene discs in air and under vacuum

2015

Graphene-based electrodes are very promising for molecular electronics and spintronics. Here we report a systematic characterization of the electroburning (EB) process, leading to the formation of nanometer-spaced gaps, on different types of few-layer graphene (namely mechanically exfoliated graphene on SiO2, graphene epitaxially grown on the C-face of SiC and turbostratic graphene discs deposited on SiO2) under air and vacuum conditions. The EB process is found to depend on both the graphene type and on the ambient conditions. For the mechanically exfoliated graphene, performing EB under vacuum leads to a higher yield of nanometer-gap formation than working in air. Conversely, for graphene…

Molecular spintronicsmolecular spintronicsMaterials sciencemolecular electronicsMolecular electronicsGeneral Physics and AstronomyNanotechnologylcsh:Chemical technologyEpitaxyGraphene based electrodeslcsh:TechnologyFull Research PaperGraphene; Graphene based electrodes; Molecular electronics; Molecular spintronics; Materials Science (all); Electrical and Electronic Engineering; Physics and Astronomy (all)law.inventionPhysics and Astronomy (all)lawNanotechnologylcsh:TP1-1185ddc:530General Materials ScienceElectrical and Electronic Engineeringlcsh:ScienceComputingMilieux_MISCELLANEOUSGraphene oxide paper[PHYS]Physics [physics]lcsh:TGraphenegraphene based electrodesPhysicsGraphene foamMolecular electronicslcsh:QC1-999NanoscienceElectrodelcsh:QMaterials Science (all)GrapheneBilayer graphenelcsh:PhysicsGraphene nanoribbons
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Helicates with Ether-Substituted Catechol Esters as Ligands

2020

European journal of organic chemistry 2020(32), 5161-5172 (2020). doi:10.1002/ejoc.202000843

Molecular switchCatecholesteritOrganic ChemistryEtherkompleksiyhdisteet540Combinatorial chemistrymolecular switchhelicatethermodynamicschemistry.chemical_compoundlitiumchemistrytermodynamiikkatemplatingddc:540supramolekulaarinen kemiacatecholatePhysical and Theoretical Chemistry
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Ion-ion correlation and charge reversal at titrating solid interfaces

2009

Confronting grand canonical titration Monte Carlo simulations (MC) with recently published titration and charge reversal (CR) experiments on silica surfaces by Dove et al. and van der Heyden it et al, we show that ion-ion correlations quantitatively explain why divalent counterions strongly promote surface charge which, in turn, eventually causes a charge reversal (CR). Titration and CR results from simulations and experiments are in excellent agreement without any fitting parameters. This is the first unambiguous evidence that ion-ion correlations are instrumental in the creation of highly charged surfaces and responsible for their CR. Finally, we show that charge correlations result in "a…

Monte Carlo methodFOS: Physical sciencesBinary compoundThermodynamics02 engineering and technologyCondensed Matter - Soft Condensed Matter010402 general chemistry01 natural sciencesIonchemistry.chemical_compoundComputational chemistryElectrochemistryTheoretical chemistryGeneral Materials ScienceSurface chargeSpectroscopyCondensed Matter - Statistical Mechanicschemistry.chemical_classificationStatistical Mechanics (cond-mat.stat-mech)Charge (physics)Surfaces and Interfaces021001 nanoscience & nanotechnologyCondensed Matter Physics0104 chemical sciences[ PHYS.PHYS.PHYS-CHEM-PH ] Physics [physics]/Physics [physics]/Chemical Physics [physics.chem-ph]chemistryddc:540Soft Condensed Matter (cond-mat.soft)Titration[PHYS.PHYS.PHYS-CHEM-PH]Physics [physics]/Physics [physics]/Chemical Physics [physics.chem-ph]Counterion0210 nano-technology
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Multiple overseas dispersal in amphibians

2003

Amphibians are thought to be unable to disperse over ocean barriers because they do not tolerate the osmotic stress of salt water. Their distribution patterns have therefore generally been explained by vicariance biogeography. Here, we present compelling evidence for overseas dispersal of frogs in the Indian Ocean region based on the discovery of two endemic species on Mayotte. This island belongs to the Comoro archipelago, which is entirely volcanic and surrounded by sea depths of more than 3500 m. This constitutes the first observation of endemic amphibians on oceanic islands that did not have any past physical contact to other land masses. The two species of frogs had previously been tho…

MovementBiogeographyMolecular Sequence DataMantellidaeBiologyphylogenyDNA MitochondrialComorosGeneral Biochemistry Genetics and Molecular BiologyEvolution MolecularAmphibiaddc:570MadagascarVicarianceAnimalsIndian OceanPhylogenybiogeographyDNA PrimersGeneral Environmental ScienceLikelihood FunctionsBase SequenceGeographyModels GeneticGeneral Immunology and MicrobiologyEcologySequence Analysis DNAGeneral MedicineSalt waterBiological dispersalAnuraGeneral Agricultural and Biological SciencesResearch Article
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Complete Measurement of the Λ Electromagnetic Form Factors.

2019

The exclusive process e+e−→ΛΛ¯, with Λ→pπ− and Λ¯→p¯π+, has been studied at s=2.396 GeV for measurement of the timelike Λ electric and magnetic form factors, GE and GM. A data sample, corresponding to an integrated luminosity of 66.9 pb−1, was collected with the BESIII detector for this purpose. A multidimensional analysis with a complete decomposition of the spin structure of the reaction enables a determination of the modulus of the ratio R=|GE/GM| and, for the first time for any baryon, the relative phase ΔΦ=ΦE−ΦM. The resulting values are R=0.96±0.14(stat)±0.02(syst) and ΔΦ=37°±12°(stat)±6°(syst), respectively. These are obtained using the recently established and most precise value of …

Multi-dimensional analysisElectron–positron annihilationRelative phaseHadronAnalytical chemistryGeneral Physics and AstronomyHadronsOBSERVABLESLambdaBaryon01 natural sciencesArticleNOHigh Energy Physics - ExperimentSubatomär fysikGermanium compoundsElectromagnetic form factorsSubatomic Physics0103 physical sciencesMagnetic form factorTwo-photon exchangePiddc:530010306 general physicsAsymmetry parameterProton Scattering; Nucleons; HydrogenPhysicsIntegrated luminosityDecompositionPhysicsHigh Energy Physics::PhenomenologyApproximation theoryPhysics multidisciplinaryPhotonHigh Energy Physics - Experiment; High Energy Physics - ExperimentBaryonLuminanceSpin structuresHigh Energy Physics::ExperimentMagnetic form factorMulti dimensional analysisBar (unit)Physical review letters
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Automated facies identification by Direct Push-based sensing methods (CPT, HPT) and multivariate linear discriminant analysis to decipher geomorpholo…

2021

In ad 1362, a major storm surge drowned wide areas of cultivated medieval marshland along the north‐western coast of Germany and turned them into tidal flats. This study presents a new methodological approach for the reconstruction of changing coastal landscapes developed from a study site in the Wadden Sea of North Frisia. Initially, we deciphered long‐term as well as event‐related short‐term geomorphological changes, using a geoscientific standard approach of vibracoring, analyses of sedimentary, geochemical and microfaunal palaeoenvironmental parameters and radiocarbon dating. In a next step, Direct Push (DP)‐based Cone Penetration Testing (CPT) and the Hydraulic Profiling Tool (HPT) wer…

Multivariate statisticsGeography Planning and DevelopmentStorm surgeLinear discriminant analysis550 Geowissenschaften550 Earth sciencesFaciesEarth and Planetary Sciences (miscellaneous)ddc:551.36ddc:550.724DECIPHERIdentification (biology)CartographyGeologyEarth-Surface Processes
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Electronic properties of single-walled carbon nanotubes inside cyclic supermolecules

2006

Possible ways for manipulating carbon nanotubes (CNTs) with cyclic supermolecules are studied using density functional theory. Electronic structure calculations with structure optimizations have been performed for the (4,4) and (8,0) single-walled carbon nanotubes (SWNTs) complexed with crown ethers as well as for the (4,0) SWNT with beta-cyclodextrin. A slight polarization of charge in both the nanotube and the supermolecule is observed upon rotaxane complexation, but the interaction is mainly repulsive, and the systems stay 2.8-3.5 A apart. The supermolecule does not affect the electronic band structure of the nanotube significantly within such a configuration. The situation differs notic…

NanotubeMaterials scienceBand gapNanotechnologyElectronic structureCarbon nanotubeSupermoleculeCondensed Matter::Mesoscopic Systems and Quantum Hall EffectSurfaces Coatings and Filmslaw.inventionJOptical properties of carbon nanotubesCondensed Matter::Materials ScienceChemical physicslawMaterials ChemistryDensity of statesDensity functional theoryddc:530Physical and Theoretical Chemistry
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