Search results for " SPECT"

showing 10 items of 11464 documents

The importance of vibronic perturbations in ferrocytochrome c spectra: a reevaluation of spectral properties based on low-temperature optical absorpt…

2005

We have measured and analyzed the low-temperature (T=10 K) absorption spectrum of reduced horse heart and yeast cytochrome c. Both spectra show split and asymmetric Q(0) and Q(upsilon) bands. The spectra were first decomposed into the individual split vibronic sidebands assignable to B(1g) (nu15) and A(2g) (nu19, nu21, and nu22) Herzberg-Teller active modes due to their strong intensity in resonance Raman spectra acquired with Q(0) and Q(upsilon) excitations. The measured band splittings and asymmetries cannot be rationalized solely in terms of electronic perturbations of the heme macrocycle. On the contrary, they clearly point to the importance of considering not only electronic perturbati…

Quantitative Biology::BiomoleculesAbsorption spectroscopyChemistryGeneral Physics and AstronomySpectral linesymbols.namesakeMolecular dynamicsElectric fieldExcited statesymbolsVibronic spectroscopyPhysical and Theoretical ChemistryAtomic physicsRaman spectroscopyLuminescenceThe Journal of chemical physics
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Spectral hole burning study of protoporphyrin IX substituted myoglobin.

1992

Protoporphyrin IX substituted myoglobin reveals excellent hole burning properties. We investigated the frequency shift of persistent spectral holes under isotropic pressure conditions in a range from 0 to 2.4 MPa. In this range, the protein behaves like an elastic solid. The shift of the holes under pressure shows a remarkable frequency dependence from which the compressibility of the protein can be determined. The compressibility, in turn, allows for an estimation of the equilibrium volume fluctuations. Within the frame of the model used to interpret the pressure data, it is possible to determine the absorption frequency of the isolated chromophore and the associated solvent shift in the p…

Quantitative Biology::BiomoleculesProtoporphyrin IXMyoglobinPhotochemistryProtein ConformationAnalytical chemistryFluorescence spectrometryBiophysicsProtoporphyrinsChromophorechemistry.chemical_compoundSpectrometry FluorescencechemistryMyoglobinSpectral hole burningCompressibilityAnimalsProtoporphyrinHorsesCompressibility factorResearch ArticleBiophysical journal
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Analysis of complex autoantibody repertoires by surface-enhanced laser desorption/ionization-time of flight mass spectrometry

2003

Normal sera contain a large number of naturally occurring autoantibodies which can mask important disease-associated ones. Western blotting has evolved as the most important tool to demonstrate autoantibodies in autoimmune diseases, because of its ability to simultaneous screening for a wide spectrum of different antigens. In previous studies we have shown the diagnostic potential of the analysis of autoantibodies in autoimmune diseases by means of multivariate statistics and artificial neural networks. However, the Western blotting procedure remains very time-consuming and is also limited in sensitivity. Therefore, we used an on-chip approach for the analysis of autoantibodies. This Protei…

Time FactorsChromatographymedicine.diagnostic_testMolecular massmedicine.drug_classChemistryBlotting WesternProtein Array AnalysisAutoantibodyMass spectrometryMonoclonal antibodySensitivity and SpecificityBiochemistryMass SpectrometrySurface-enhanced laser desorption/ionizationMolecular WeightBlotWestern blotSpectrometry Mass Matrix-Assisted Laser Desorption-IonizationmedicineHumansTime-of-flight mass spectrometryMolecular BiologyAutoantibodiesPROTEOMICS
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A guide to indicators for the evaluation of specialist autism centres, based on the quality-of-life model

2017

Objective: The evaluation of individual and organizational quality of life through the Guide to Quality-of-Life Indicators and its promotion in English-speaking areas. This guide was initially designed for people living with Autism Spectrum Disorder in specialist autism centers in Spanish and Italian-speaking areas where its effectiveness has been validated. Method: The Delphi technique is applied to the design of a qualitative investigation, with expert validation for the adaptation to English-speaking areas. Results: The results have facilitated the adaptation and validation of the tool, which has 68 indicators grouped into six areas, for its application in both the planning and the evalu…

Program evaluation030506 rehabilitationmedia_common.quotation_subject05 social sciencesApplied psychologyDelphi methodTest validitymedicine.diseaseOriginal Research Paper03 medical and health sciencesPsychiatry and Mental healthPromotion (rank)Quality of lifeAutism spectrum disorderDevelopmental and Educational PsychologymedicineAutism0501 psychology and cognitive sciences0305 other medical sciencePsychologyAdaptation (computer science)050104 developmental & child psychologyClinical psychologymedia_commonInternational Journal of Developmental Disabilities
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On the blue phase structure of hydrogen-bonded liquid crystals via 19F NMR

2018

Abstract 19 F NMR spectra are simulated for blue phase I of FPHG( St 1.5 ∗ Ap 1.5 ) based on a model of a double-twisted substructure inside cylinders that form a body-centred cubic lattice. A kinetic matrix is included to describe jump processes over quarter pitch lengths. Though the lines in the NMR spectra are broad and featureless, changes in the widths and positions with temperature are well described by the blue phase model structure. The spectra in the chiral nematic N∗ phase are also simulated. Dynamics in the BP I are found to be slower than in the N∗ phase.

Materials scienceHydrogenSpectral simulationChemieGeneral Physics and Astronomychemistry.chemical_elementBlue phase IDouble-twisted substructure02 engineering and technologyFluorine-19 NMR010402 general chemistryKinetic energy01 natural sciencesMolecular physicsSpectral lineDiffusion rateLiquid crystalLattice (order)Physical and Theoretical Chemistry021001 nanoscience & nanotechnologyFluorine NMR0104 chemical sciencesNMR spectra databasechemistrySubstructureSettore CHIM/07 - Fondamenti Chimici Delle Tecnologie0210 nano-technologyChiral nematic
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Aqueous enzymatic process assisted by microwave extraction of oil from yellow horn (Xanthoceras sorbifolia Bunge.) seed kernels and its quality evalu…

2013

Abstract In this study, aqueous enzymatic process (AEP) assisted by microwave extraction (ME) of oil from yellow horn ( Xanthoceras sorbifolia Bunge.) seed kernel was investigated. Central composite design (CCD) and response surface methodology (RSM) were used to optimise an enzyme cocktail (cellulase, hemicellulase, pectinase) for AEP. The main factors of ME were also studied. A maximal oil extraction yield of 55.8% was achieved under optimal conditions. Moreover, scanning electron microscope (SEM) was applied to characterise the extraction process. Analysing chemical composition of the extracted oil by GC–MS showed that the content of unsaturated fatty acids by this emerging method (91.18…

Quality ControlChromatographyAqueous solutionCentral composite designbiologyGlycoside HydrolasesChemistryExtraction (chemistry)General MedicineCellulaseChemical FractionationGas Chromatography-Mass SpectrometryAnalytical ChemistrySapindaceaeYield (chemistry)Seedsbiology.proteinPlant OilsResponse surface methodologyPectinaseMicrowavesChemical compositionFood ScienceFood chemistry
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Endothelium- and nitric oxide-dependent vasorelaxing activities of gamma-butyrobetaine esters: possible link to the antiischemic activities of mildro…

2004

Mildronate [3-(2,2,2-trimethylhydrazine) propionate (THP)] is an antiischemic drug acting mainly via inhibition of fatty acid beta-oxidation. Some effects of the drug cannot be explained by the latter mechanism. We tested the eventual nitric oxide (NO) dependence of the mildronate action. Mildronate, gamma-butyrobetaine (GBB) and GBB methyl ester induced transient increases in nitric oxide (NO) concentrations in rat blood and myocardium. In vitro, these compounds neither modified the activities of purified neuronal and endothelial recombinant nitric oxide synthases (NOSs) nor were able to interact with their active site. GBB induced vasodilatation at high concentrations only (EC50 = 5 x 10(…

MaleEndotheliumNitric Oxide Synthase Type IIIStereochemistryDrug Evaluation PreclinicalMyocardial IschemiaVasodilationAorta ThoracicNitric OxideMuscle Smooth VascularNitric oxidechemistry.chemical_compoundCarnitinemedicineAnimalsEndotheliumRats WistarPharmacologychemistry.chemical_classificationbiologyElectron Spin Resonance SpectroscopyActive siteFatty acidDrug SynergismRatsNitric oxide synthaseBetaineVasodilationDrug Combinationsmedicine.anatomical_structureEnzymeNG-Nitroarginine Methyl Esterchemistrybiology.proteinPropionateNitric Oxide SynthaseDitiocarbMethylhydrazinesEuropean journal of pharmacology
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Diode laser spectroscopy of the nu(8) band of the SF(5)Cl molecule.

2003

Abstract Diode laser spectra of SF 5 Cl have been recorded in the ν 8 band region at a temperature of ca. 240 K, a pressure of 0.25 mbar and an instrumental bandwidth of ca. 0.001 cm −1 . Four regions have been studied: a first one in the P -branch (906.849–907.687 cm −1 ), a second one in the Q -branch (910.407–910.944 cm −1 ), and two other ones in the R -branch (913.957–914.556 and 917.853–918.705 cm −1 ). The whole ν 1 / ν 8 dyad of SF 5 35 Cl has been previously recorded in the group of Professor H. Burger in Wuppertal, thanks to a Fourier transform infrared spectrometer [J. Mol. Spectrosc. 208 (2001) 169]. These data have thus been combined with our diode laser ones in the aim of refi…

Sulfur CompoundsChemistryLasersFluorine CompoundsAnalytical chemistryInfrared spectroscopyLaserAtomic and Molecular Physics and OpticsSpectral lineAnalytical Chemistrylaw.inventionsymbols.namesakeFourier transformChlorideslawSpectrophotometryData Interpretation StatisticalsymbolsAtomic physicsFourier transform infrared spectroscopyGround stateHamiltonian (quantum mechanics)InstrumentationSpectroscopyDiodeSpectrochimica acta. Part A, Molecular and biomolecular spectroscopy
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Diastereoselective Synthesis of Dialkylated Bis(phosphino)ferrocenes: Their Use in Promoting Silver-Mediated Nucleophilic Fluorination of Chloroquino…

2017

International audience; The diastereoselective synthesis of dialkylated ferrocenyl bis(phosphane)s bearing aryl, alkyl, and hetero- or polycyclic substituents on the phosphino groups is reported, together with their characterization in the solid state by X-ray structure analysis and in solution by multinuclear NMR spectroscopy. Introduction of various alkyl groups on the ferrocene backbone, namely, tert-butyl, isopropyl, and trimethylsilyl, has a significant influence on the stereoselectivity of the ensuing lithiation/phosphination reactions. Only the introduction of the tert-butyl groups ensures both a high yield and perfect diastereoselectivity, which leads to the exclusive formation of t…

Diastereoselectivitybond formationTrimethylsilylfunctionalized arylone-potelectrophilic fluorinationPhosphanesAlkylationc-h fluorination[CHIM.INOR]Chemical Sciences/Inorganic chemistry010402 general chemistry01 natural sciencesMedicinal chemistryInorganic Chemistrychemistry.chemical_compoundNucleophileFluorinationOrganic chemistryAlkylpolyphosphane ligandsferrocenyl derivativeschemistry.chemical_classificationp-31 nmr010405 organic chemistryArylHalex reactiondirect arylationreductive elimination[ CHIM.INOR ] Chemical Sciences/Inorganic chemistryNuclear magnetic resonance spectroscopySandwich complexes0104 chemical scienceschemistryFerroceneIsopropyl
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Generalized bloch equations for optical interactions in confined geometries

2005

By combining the field-susceptibility technique with the optical Bloch equations, a general formalism is developed for the investigation of molecular photophysical phenomena triggered by nanometer scale optical fields in the presence of complex environments. This formalism illustrate the influence of the illumination regime on the fluorescence signal emitted by a single molecule in a complex environment. In the saturated case, this signal is proportional to the optical local density of states, while it is proportional to the near-field intensity in the non-saturated case. (C) 2005 Elsevier B.V. All rights reserved.

PhysicsMicroscopyLocal density of statesGeneral Physics and AstronomySingle-Molecule SpectroscopyFluorescenceScaleFormalism (philosophy of mathematics)Bloch equationsQuantum mechanicsNear-FieldLight-SourceMoleculeDielectricsMaxwell-Bloch equationsPhysical and Theoretical ChemistryChemical Physics Letters
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