Search results for "ISOTOPES"

showing 10 items of 1216 documents

CONCENTRATION MEASUREMENTS OF 7Be AT GROUND LEVEL AIR AT PALERMO, ITALY- COMPARISON WITH SOLAR ACTIVITY OVER A PERIOD OF 21 YEARS

2003

Air activity concentrations of (7)Be in Palermo determined for the period January 1995-December 2002 by gamma-ray spectrometric analysis of particulate samples collected on paper filter by a high-volume sampler (approximately 900 m(3) h(-1)) are reported. The temporal behaviour of (7)Be concentration presents the same characteristics already observed in the measurements carried out over the previous 13-year (1982-1994) investigated period. The mean value of 5.06 mBq m(-3) obtained from the analysis of the 4636 particulate samples collected from 1982 to 2002 can be considered a representative value of (7)Be air concentration at ground level in our geographical zone. The comparison of long-te…

MeteorologyPeriod (periodic table)Health Toxicology and MutagenesisSolar activityAir pollutionAtmospheric sciencesmedicine.disease_causePalermoTroposphere7BemedicinePaper filterEnvironmental ChemistryInverse correlationWaste Management and DisposalRadioisotopesActivity concentrationMean valueGeneral MedicineParticulatesHistory 20th CenturyPollutionTemporal variationGround levelSpectrometry GammaItalyEnvironmental scienceBerylliumCosmic RadiationEnvironmental Monitoring
researchProduct

1H and 13C NMR signal assignment of synthetic (-)-methyl thyrsiflorin B acetate, (-)-thyrsiflorin C and several scopadulane derivatives.

2005

The 1H and 13C NMR signal assignment of the data of 13 scopadulane-type diterpenes is reported. It was based on one- and two- dimensional NMR techniques which included 1H, 13C, DEPT, HMQC and 1D NOE difference spectroscopy. Copyright © 2005 John Wiley & Sons, Ltd.

Methyl thyrsiflorin B acetateCarbon IsotopesMagnetic Resonance SpectroscopyStereochemistryChemistryMolecular ConformationStereoisomerismGeneral ChemistryCarbon-13 NMRDEPTReference StandardsSignalThyrsiflorin CProton NMRGeneral Materials ScienceDiterpenesProtonsSpectroscopyMagnetic resonance in chemistry : MRC
researchProduct

Noble gas and CO2 isotopic signatures of the lithospheric mantle underneath Mexico and the Canary Islands: clues from mantle xenoliths and arc lavas

2022

Studying the isotopic composition of fluids trapped in mantle xenoliths opens avenues to understand the origin and cycling of volatiles in the Earth’s upper mantle. In this PhD dissertation, new and in most cases the very first data regarding the isotopic (noble gases and CO2) characterization of the lithospheric mantle portions of three different geodynamic environments are presented: (i) Central and NW Mexico, a continental setting dominated by extension; (ii) the Transmexican Volcanic Belt (TMVB) a subduction setting, and (iii) the Canary Islands, particularly El Hierro and Lanzarote, two oceanic islands formed by mantle plume-derived intraplate volcanism. In total 32 peridotites (includ…

Mexico Canary Islands lithospheric mantle subduction mantle plume continental rift Basin and Range volcanism mantle xenoliths fluid inclusions noble gas isotopes carbon isotopes carbon recycling refertilization.Settore GEO/08 - Geochimica E Vulcanologia
researchProduct

Sedimentology, petrography and geochemistry of a limestone breccia (Pietra di Billiemi) from NW Sicily, Italy: implications for evolution of the Teth…

2009

In this study, the Pietra di Billiemi, a famous dimension stone, is investigated because it records the tectonic evolution of the south Tethys continental margin and preserves a record of major environmental changes occurring near the Triassic/Jurassic boundary. The Pietra di Billiemi is a grey, coarse-grained and clast-supported limestone breccia cropping out in an area of the Palermo Mountains representing a segment of the Apennine–Maghrebian chain in western Sicily. The rock consists of metre-sized to centimetre-sized angular clasts, derived from Upper Triassic sponge boundstones and rudstones, with a differently coloured, silt-grained matrix. Fitted fragments are observed commonly which…

MicriteCarbonate platformStratigraphyAnoxic conditions authigenic minerals in situ breccia isotopes Sicily Triassic–Jurassic boundary.DolomiteGeochemistryGeologyAuthigenicPetrographyPaleontologychemistry.chemical_compoundchemistryAnoxic conditions; Authigenic minerals; In situ breccia; Isotopes; Sicily; Triassic-Jurassic boundary; Geology; StratigraphyBrecciaCarbonateSedimentologyGeology
researchProduct

Determination of enrichment factors for modified RNA in MeRIP experiments

2019

In the growing field of RNA modification, precipitation techniques using antibodies play an important role. However, little is known about their specificities and protocols are missing to assess their effectiveness. Here we present a method to assess enrichment factors after MeRIP-type pulldown experiments, here exemplified with a commercial antibody against N6-methyladenosine (m6A). Testing different pulldown and elution conditions, we measure enrichment factors of 4-5 using m6A-containing mRNAs against an unmodified control of identical sequence. Both types of mRNA carry 32P labels at different nucleotides, allowing their relative quantification in a mixture after digestion to nucleotides…

Models MolecularAdenosineAbsolute quantificationMethylationProtein Structure SecondaryGeneral Biochemistry Genetics and Molecular BiologyViral Proteins03 medical and health sciencesAdenosine TriphosphateRNA modificationEscherichia coliHumansImmunoprecipitationProtein Interaction Domains and MotifsNucleotideRNA MessengerMolecular Biology030304 developmental biologychemistry.chemical_classification0303 health sciencesMessenger RNACell-Free SystemChemistryElution030302 biochemistry & molecular biologyRNADNA-Directed RNA PolymerasesBiochemistryImmunoglobulin GIsotope LabelingChromatography Thin LayerPhosphorus RadioisotopesProtein BindingMethods
researchProduct

Unraveling the role of protein dynamics in dihydrofolate reductase catalysis

2013

Protein dynamics have controversially been proposed to be at the heart of enzyme catalysis, but identification and analysis of dynamical effects in enzyme-catalyzed reactions have proved very challenging. Here, we tackle this question by comparing an enzyme with its heavy ((15)N, (13)C, (2)H substituted) counterpart, providing a subtle probe of dynamics. The crucial hydride transfer step of the reaction (the chemical step) occurs more slowly in the heavy enzyme. A combination of experimental results, quantum mechanics/molecular mechanics simulations, and theoretical analyses identify the origins of the observed differences in reactivity. The generally slightly slower reaction in the heavy e…

Models MolecularComputational chemistryStereochemistryKineticsBiophysicsMolecular Dynamics SimulationTritiumCatalysisEnzyme catalysisReaction coordinateReaction rateMolecular dynamicsQuantum biologyEscherichia coliReactivity (chemistry)Carbon IsotopesQuantum biologyMultidisciplinaryNitrogen IsotopesChemistryProtein dynamicsBiological chemistryProteinsTetrahydrofolate DehydrogenaseKineticsChemical physicsPhysical Sciences
researchProduct

A computationally feasible quantum chemical model for 13C NMR chemical shifts of PCB-derived carboxylic acids.

2004

Two quantum chemical models have been derived for the prediction of 13C NMR chemical shifts of novel PCB acids obtained from PCBs by catalytic carbonylation. 13C isotropic shielding constants were calculated employing the GIAO (gauge-independent atomic orbital) method with density functional theory (DFT). The best results were obtained by cluster calculations, which took the solvent effects into account properly. In this approach, a solvent molecule (acetone) was attached by a hydrogen bond to every hydrogen atom present in a PCB acid, and the geometry of the molecular cluster was optimized employing the AM1 method. For 158 chemical shifts, the cross-validated standard error was 2.8 ppm and…

Models MolecularEnvironmental EngineeringMagnetic Resonance SpectroscopyHealth Toxicology and MutagenesisCarboxylic AcidsQuantum chemistryAtomic orbitalEnvironmental ChemistryQuantitative Biology::BiomoleculesCarbon IsotopesMolecular StructureHydrogen bondChemistryChemical shiftPublic Health Environmental and Occupational HealthGeneral MedicineGeneral ChemistryHydrogen atomCarbon-13 NMRPollutionPolychlorinated BiphenylsModels ChemicalSolventsPhysical chemistryQuantum TheoryDensity functional theoryEnvironmental PollutantsSolvent effectsSoftwareChemosphere
researchProduct

Role of Solvent on Nonenzymatic Peptide Bond Formation Mechanisms and Kinetic Isotope Effects

2013

Based on the hypothesis that similar mechanisms are involved in the peptide bond formation in aqueous solution and in the ribosome, the aminolysis of esters in aqueous solution has been the subject of numerous studies as the reference reaction for the catalyzed process. The mechanisms proposed in the literature have been explored in the present paper by hybrid QM/MM molecular dynamics simulations. The free energy profiles have been computed with the QM region of the system described at semiempirical AM1 level and by DFT within the M06-2X functional. According to the results, the formation of adduct zwitterion species is a preliminary step required for all possible mechanisms. Then, from dif…

Models MolecularEster aminolysisMolecular Dynamics SimulationMethyl formateBiochemistryCatalysisMolecular dynamicschemistry.chemical_compoundColloid and Surface ChemistryAminolysisIsotopesComputational chemistryKinetic isotope effectOrganic chemistryPeptide bondConformational isomerismDensity functionalsChemistryAqueous-solutionGeneral ChemistryHydrazinolysisRibosomeTransition stateKineticsSolvation shellChorismate mutaseZwitterionSolventsTransition-state structuresPeptides
researchProduct

DOTAGA-Trastuzumab. A New Antibody Conjugate Targeting HER2/Neu Antigen for Diagnostic Purposes.

2012

International audience; Improved bifunctional chelating agents (BFC) are required for indium-111 radiolabeling of monoclonal antibodies (mAbs) under mild conditions to yield stable, target-specific agents. 2,2',2″-(10-(2,6-Dioxotetrahydro-2H-pyran-3-yl)-1,4,7,10-tetraazacyclododecane-1,4,7-triyl)triacetic acid (DOTAGA-anhydride) was evaluated for mAb conjugation and labeling with indium-111. The DOTA analogue was synthesized and conjugated to trastuzumab-which targets the HER2/neu receptor-in mild conditions (PBS pH 7.4, 25 °C, 30 min) and gave a mean degree of conjugation of 2.6 macrocycle per antibody. Labeling of this immunoconjugate with indium-111 was performed in 75% yield after 1 h a…

Models MolecularImmunoconjugatesReceptor ErbB-2Pharmaceutical Science[CHIM.THER]Chemical Sciences/Medicinal Chemistry[ SDV.CAN ] Life Sciences [q-bio]/CancerMicechemistry.chemical_compound0302 clinical medicineTrastuzumabBreastMice Inbred BALB C0303 health sciencesbiologyChemistry[CHIM.ORGA]Chemical Sciences/Organic chemistryIndium Radioisotopes[ CHIM.COOR ] Chemical Sciences/Coordination chemistry[ CHIM.THER ] Chemical Sciences/Medicinal Chemistry3. Good healthBiochemistry030220 oncology & carcinogenesisMonoclonalFemaleAntibody[CHIM.RADIO]Chemical Sciences/Radiochemistry[ CHIM.RADIO ] Chemical Sciences/RadiochemistryBiotechnologymedicine.drugBiodistributionmedicine.drug_classBiomedical EngineeringBreast NeoplasmsBioengineering[SDV.CAN]Life Sciences [q-bio]/CancerAntibodies Monoclonal HumanizedMonoclonal antibodyAnhydridesHeterocyclic Compounds 1-Ring03 medical and health sciences[ CHIM.ORGA ] Chemical Sciences/Organic chemistryCell Line TumormedicineAnimalsHumansDOTA[CHIM.COOR]Chemical Sciences/Coordination chemistry030304 developmental biologyTomography Emission-Computed Single-PhotonPharmacologyOrganic ChemistryTrastuzumabMolecular biologyIn vitroImmunoconjugatebiology.protein
researchProduct

What is the form of muscimol from fly agaric mushroom (Amanita muscaria) in water? An insight from NMR experiment supported by molecular modeling.

2020

ARTYKUŁ Z BADAŃ SPECJALNYCH

Models MolecularMagnetic Resonance SpectroscopyAmanita010402 general chemistry01 natural scienceschemistry.chemical_compoundReceptors GABAComputational chemistryMoleculeHumansGeneral Materials ScienceGABA-A Receptor Antagonistsindirect spin‐spin coupling constantsNMR in waterDensity Functional TheoryCarbon Isotopesbiology010405 organic chemistryAgaricmolecular modelingMuscimolChemical shiftWaterGeneral ChemistryCarbon-13 NMRbiology.organism_classification0104 chemical sciencesSolventnervous systemchemistryMuscimolGIAO NMRZwitterionProtonsAmanita muscariaMagnetic resonance in chemistry : MRCREFERENCES
researchProduct