Search results for "MT"

showing 10 items of 2759 documents

Ba$^{2+}$ ion trapping by organic submonolayer: towards an ultra-low background neutrinoless double beta decay detector

2022

If neutrinos are their own antiparticles, the otherwise-forbidden nuclear reaction known as neutrinoless double beta decay ($\beta\beta 0\nu$) can occur, with a characteristic lifetime which is expected to be very long, making the suppression of backgrounds a daunting task. It has been shown that detecting (``tagging'') the Ba$^{+2}$ dication produced in the double beta decay ${}^{136}\mathrm{Xe} \rightarrow {}^{136}$Ba$^{+2}+ 2 e + (2 \nu)$ in a high pressure gas experiment, could lead to a virtually background free experiment. To identify these \Bapp, chemical sensors are being explored as a key tool by the NEXT collaboration . Although used in many fields, the application of such chemose…

Chemical Physics (physics.chem-ph)High Energy Physics - Experiment (hep-ex)Condensed Matter - Materials SciencePhysics - Chemical PhysicsMaterials Science (cond-mat.mtrl-sci)FOS: Physical sciencesHigh Energy Physics - Experiment
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New Pressure-Induced Polymorphic Transitions of Anhydrous Magnesium Sulfate

2017

The effects of pressure on the crystal structure of the three known polymorphs of magnesium sulfate have been theoretically study by means of DFT calculations up to 45 GPa. We determined that at ambient conditions gamma MgSO4 is an unstable polymorph, which decompose into MgO and SO3, and that the response of the other two polymorphs to hydrostatic pressure is non isotropic. Additionally we found that at all pressures beta MgSO4 has a largest enthalpy than alpha MgSO4. This indicates that beta MgSO4 is thermodynamically unstable versus alpha MgSO4 and predicts the occurrence of a beta alpha phase transition under moderate compression. Our calculations also predict the existence under pressu…

Chemical Physics (physics.chem-ph)Phase transitionBulk modulusCondensed Matter - Materials ScienceMaterials scienceCoordination numberHydrostatic pressureEnthalpyfungiThermodynamicsMaterials Science (cond-mat.mtrl-sci)FOS: Physical sciences02 engineering and technologyCrystal structure021001 nanoscience & nanotechnology01 natural sciencesInorganic ChemistryPhase (matter)MetastabilityPhysics - Chemical Physics0103 physical sciences010306 general physics0210 nano-technology
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Insights on the origin of catalysis on glycine N-methyltransferase from computational modeling.

2018

The origin of enzyme catalysis remains a question of debate despite much intense study. We report a QM/MM theoretical study of the SN2 methyl transfer reaction catalyzed by a glycine N-methyltransferase (GNMT) and three mutants to test whether recent experimental observations of rate-constant reductions and variations in inverse secondary α-3H kinetic isotope effects (KIEs) should be attributed to changes in the methyl donor−acceptor distance (DAD): is catalysis due to a compression effect? Semiempirical (AM1) and DFT (M06-2X) methods were used to describe the QM subset of atoms, while OPLS-AA and TIP3P classical force fields were used for the protein and water molecules, respectively. The …

Chemistry(all)Static ElectricityMolecular ConformationGlycine N-Methyltransferase010402 general chemistry01 natural sciencesenzyme catalysisQM/MMBiochemistryArticleCatalysisEnzyme catalysisCatalysisColloid and Surface ChemistryComputational chemistryKinetic isotope effectMolecule/dk/atira/pure/subjectarea/asjc/1600/dk/atira/pure/subjectarea/asjc/1300/1303/dk/atira/pure/subjectarea/asjc/1500/1505biology010405 organic chemistryChemistryActive siteGeneral ChemistryGlycine N-methyltransferase0104 chemical sciencesKineticsGNMTBiocatalysisbiology.proteinQuantum TheorySN2 reaction/dk/atira/pure/subjectarea/asjc/1500/1503
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Femtosecond polarization spectroscopy in molecular gas mixtures: Macroscopic interference and concentration measurements

2000

0021-9606; Raman-induced polarization spectroscopy (RIPS) experiments combined with homodyne detection have been conducted with a femtosecond laser at room temperature and low pressure (p < 2 atm) in CO2-N2 mixtures as well as in air (O2-N2 mixtures). Each molecule of the mixture produces its own time-dependent signal, measured as a series of recurring transients. Macroscopic interference is observed when transients of both molecules overlap in the time domain. This interference leads to a large modification of the signal, which is well reproduced by calculations. The total signal recorded in CO2-N2 or O2-N2 mixtures of known concentration is analyzed in order to measure the polarizability …

ChemistryAIRAnalytical chemistryGeneral Physics and AstronomyPolarization (waves)01 natural sciencesINVERSE RAMAN-SPECTROSCOPYROTATIONAL COHERENCE010309 opticssymbols.namesakeHomodyne detectionPolarizability0103 physical sciencesFemtosecondsymbolsCO2Time domainPhysical and Theoretical Chemistry010306 general physicsAnisotropySpectroscopyRaman spectroscopy
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Temperature measurement in gas mixtures by femtosecond Raman-induced polarization spectroscopy

2003

The potential of femtosecond Raman-induced polarization spectroscopy (RIPS) for the simultaneous determination of temperature and concentrations was investigated. These measurements were related to the rotational time response of the molecular gas mixture, which was measured as a function of the pump-probe time delay. The change of the polarizability anisotropy with respect to the vibrational levels was taken into account. The results of temperature measurements in pure CO2 showed good agreement with the values obtained by a thermocouple. The RIPS technique was also applied to a CO2-N2 gas mixture to determine simultaneously temperatures and concentrations at temperatures up to 600 K. The a…

ChemistryAnalytical chemistryInduced polarizationTemperature measurementsymbols.namesakeThermocouplePolarizabilityFemtosecondsymbolsGeneral Materials ScienceAnisotropyRaman spectroscopySpectroscopySpectroscopyJournal of Raman Spectroscopy
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Determination of concentrations in ternary and quaternary molecular gas mixtures using femtosecond Raman spectroscopy

2002

Measurements of concentrations in gas mixtures of three and four molecular components are presented. They rely on a femtosecond time-resolved pump–probe technique based on Raman-induced polarization spectroscopy. The rotational time response of the molecular gas mixture is measured as a function of the pump–probe time delay. No selective frequency tunability is needed as the molecular rotational spectra are excited within the laser bandwidth. The results obtained from experiments performed at room temperature in N2O–CO2–N2 and N2O–CO2–O2–N2 mixtures are presented and the accuracy of the method is discussed. Copyright © 2002 John Wiley & Sons, Ltd.

ChemistryAnalytical chemistryPolarization (waves)LaserSpectral linelaw.inventionsymbols.namesakelawExcited stateFemtosecondsymbolsGeneral Materials ScienceRaman spectroscopySpectroscopyTernary operationSpectroscopyJournal of Raman Spectroscopy
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Femtosecond Transient Absorption Study of the Dynamics of Acrylodan in Solution and Attached to Human Serum Albumin

2003

The excited-state relaxation dynamics of the protein-labeling dye acrylodan in solution and attached to human serum albumin has been studied by femtosecond transient absorption spectroscopy. Time-resolved spectra and kinetics of stimulated emission and excited-state absorption in the wavelength region from 400 to 800 nm were studied in ethanol and dimethylformamide. The excited-state solvation dynamics is characterized by multiexponential behavior in both solvents. In ethanol solution, the time dependence of the transient spectra is interpreted in terms of fast solvent relaxation followed by excited-state isomerization of the dye. Acrylodan attached to the protein shows a relaxation compone…

ChemistryKineticsSolvationAnalytical chemistryHuman serum albuminPhotochemistryFluorescenceSurfaces Coatings and FilmsFemtosecondUltrafast laser spectroscopyMaterials ChemistrymedicineRelaxation (physics)Physical and Theoretical ChemistryAbsorption (chemistry)medicine.drugThe Journal of Physical Chemistry B
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Dynamics of ground and excited state chlorophylla molecules in pyridine solution probed by femtosecond transient absorption spectroscopy

1999

Abstract Femtosecond pump–probe spectroscopy was used to investigate the ground and excited state dynamics of chlorophyll  a (Chl  a ) in pyridine following excitation by a 100 fs optical pulse. The transient absorption spectrum and kinetics reveal spectral evolution on two ultrafast time scales: ∼100 fs and ∼3 ps. We attribute these dynamics to ground-state transient hole-burning and solvation dynamics. Transient absorption anisotropy at early times (∼500 fs) was measured for Chl  a in pyridine and shows a pronounced wavelength dependence, where anisotropy varies between 0 and 0.5. Strong contribution from excited state absorption is the origin of the variation.

ChemistrySolvationGeneral Physics and Astronomy02 engineering and technology010402 general chemistry021001 nanoscience & nanotechnology01 natural sciences0104 chemical sciencesExcited stateUltrafast laser spectroscopyFemtosecondPhysical and Theoretical ChemistryAtomic physics0210 nano-technologySpectroscopyAnisotropyUltrashort pulseExcitationChemical Physics Letters
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Comparative cytotoxicity evaluation of eight root canal sealers

2017

Background The aim of the present study is to evaluate and compare the cytotoxic effects of eight root canal sealers (BioRoot RCS, TotalFill BC Sealer, MTA Fillapex, Sealapex, AH Plus, EasySeal, Pulp Canal Sealer, N2) on immortalized human gingival fibroblasts over a period of 24, 48 and 72 hours. Material and Methods Immortalized human gingival fibroblast-1 HGF-1 (ATCC CRL-2014) were incubated. Root canal sealers were then placed into sterile, cylindrical Teflon moulds. The extraction was made eluting the sealers in cell culture medium. Cells (1 × 104) were seeded in each well of a 96-well plate and incubated for 24 h at 37°C. Cultures were then exposed to 100 μL of the extracts medium. Th…

Chemistrybusiness.industryResearchRoot canalExtraction (chemistry)Dentistry030206 dentistry:CIENCIAS MÉDICAS [UNESCO]Molecular biologyOperative Dentistry and Endodontics03 medical and health sciences0302 clinical medicinemedicine.anatomical_structureMTA-FillapexUNESCO::CIENCIAS MÉDICASPulp canalmedicineCytotoxic T cellGingival fibroblastCytotoxicitybusinessGeneral Dentistry030217 neurology & neurosurgery
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Clinical Course and Significance of the Novel FLT3-Y842C Mutation in a Patient with AML Treated with PKC412 Monotherapy.

2004

Abstract We recently identified a novel mutation (Y842C) within the tyrosine kinase domain of FLT3 in a patient treated with PKC410 monotherapy (ASH 2003, # 4681). Here, we present follow up studies including the clinical course of the patient and frequency analysis in 110 patients with AML. In addition, we characterized the novel mutation using overexpression of FLT3-Y842C in 32D cells. AML M2 was diagnosed in a 63 year old, male patient in 1993. After having experienced his second relapse upon standard therapy the patient was refractory to alemtuzumab treatment. Due to reduced performance status the patient was not eligible to standard chemotherapy and was enrolled into a phase II trial i…

ChemotherapyPerformance statusbusiness.industryPoint mutationmedicine.medical_treatmentImmunologyhemic and immune systemsCell BiologyHematologyBioinformaticsBiochemistryExonfluids and secretionshemic and lymphatic diseasesembryonic structuresCancer researchmedicineAlemtuzumabClinical significancebusinessTyrosine kinaseEx vivomedicine.drugBlood
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