Search results for "CERAMICS"

showing 10 items of 1599 documents

Photoinduced intersystem crossing in DNA oxidative lesions and epigenetic intermediates

2020

[EN] The propensity of 5-formyluracil and 5-formylcytosine, i.e. oxidative lesions and epigenetic intermediates, in acting as intrinsic DNA photosensitizers is unraveled by using a combination of molecular modeling, simulation and spectroscopy. Exploration of potential energy surfaces and non-adiabatic dynamics confirm a higher intersystem crossing rate for 5-formyluracil, whereas the kinetic models evidence different equilibria in the excited states for both compounds.

Models MolecularMolecular modelLightOxidative phosphorylation010402 general chemistry01 natural sciencesCatalysisEpigenesis Geneticchemistry.chemical_compoundCytosineQUIMICA ORGANICAMaterials Chemistry[CHIM]Chemical SciencesHumansComputer SimulationEpigeneticsSpectroscopyUracilComputingMilieux_MISCELLANEOUS010405 organic chemistryChemistryMetals and AlloysGeneral ChemistryDNAPotential energy0104 chemical sciencesSurfaces Coatings and FilmsElectronic Optical and Magnetic MaterialsKineticsIntersystem crossingExcited stateCeramics and CompositesBiophysicsOxidation-ReductionDNAMutagens
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Magneto-optical nanomaterials: a SPIO–phthalocyanine scaffold built step-by-step towards bimodal imaging

2013

A SPIO-phthalocyanine nanohybrid is developed as a bimodal contrast agent for Optical and Magnetic Resonance Imaging. The organic coating was covalently attached onto SPIO in a step-by-step approach. Each coated-SPIO was thoroughly characterized. The hydrodynamic size of the SPIO-Pc is ca. 60 nm with a coverage of ca. 690 Pc/SPIO.

Models MolecularScaffoldIndolesMaterials scienceContrast MediaNanoparticleNanotechnology02 engineering and technologyIsoindolesengineering.material010402 general chemistry01 natural sciencesCatalysisNanomaterialsMagneto opticalchemistry.chemical_compoundCoatingMaterials Chemistry[CHIM]Chemical SciencesComputingMilieux_MISCELLANEOUSMetals and AlloysGeneral Chemistry021001 nanoscience & nanotechnologyMagnetic Resonance ImagingFerrosoferric Oxide0104 chemical sciencesSurfaces Coatings and FilmsElectronic Optical and Magnetic MaterialschemistryCeramics and CompositesPhthalocyanineengineeringNanoparticles0210 nano-technologyChemical Communications
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Fracture Resistance of New Metal-Free Materials Used for CAD-CAM Fabrication of Partial Posterior Restorations

2020

Background and Objectives: To evaluate in vitro the fracture resistance and fracture type of computer-aided design and computer-aided manufacturing (CAD-CAM) materials. Materials and Methods: Discs were fabricated (10 &times

MolarCeramicschemistry.chemical_elementArticleStress (mechanics)Dental MaterialsGroup (periodic table)Tensile StrengthMaterials TestingDentinHumansMedicineCeramicComposite materialDental Restoration PermanentComputingMethodologies_COMPUTERGRAPHICSlcsh:R5-920business.industryWeibull modulusGeneral Medicinefracture resistance; resin nanoceramic; polymer-infiltrated ceramic network; lithium disilicate; zirconium-reinforced lithium silicatefracture resistancezirconium-reinforced lithium silicateDental PorcelainNanostructuresmedicine.anatomical_structurechemistrypolymer-infiltrated ceramic networkCase-Control Studiesvisual_artFracture (geology)visual_art.visual_art_mediumComputer-Aided DesignLithiumZirconiumresin nanoceramiclithium disilicatebusinesslcsh:Medicine (General)Medicina
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<i>In vitro</i> evaluation of microleakage in Class II composite restorations: High-viscosity bulk-fill <i>vs</i> conventiona…

2019

This study compared marginal microleakage of Class II cavities restored with bulk-fill resin (Filtek™ Bulk Fill) and conventional composite resin (Filtek™ Supreme XTE). Two standardized Class II cavities were prepared in forty extracted human molars. The gingival margin was located above the cemento-enamel junction for twenty molars (groups 1 and 2) and apically for the other twenty (groups 3 and 4) (n=20). The occlusomesial cavity was filled with bulk-fill resin by insertion in bulk (groups 1 and 3) and the occlusodistal cavity was restored with conventional composite using incremental technique (groups 2 and 4). The teeth were thermocycled (500 cycles 5-55°C), stained and observed under l…

MolarMaterials scienceEnamel paint0206 medical engineeringComposite numberSignificant differenceBulk fill compositeBulk fill030206 dentistry02 engineering and technology020601 biomedical engineering03 medical and health sciences0302 clinical medicinemedicine.anatomical_structurestomatognathic systemvisual_artCeramics and CompositesDentinmedicinevisual_art.visual_art_mediumComposite materialGeneral DentistryGingival marginDental Materials Journal
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Synthesis and molecular properties of donor–π-spacer–acceptor ynamides with up to four conjugated alkyne units

2010

A set of push-pull ynamides with up to four conjugated triple bonds has been synthesized and the molecular properties of these new carbon rods have been characterised showing effective intramolecular charge transfers and high values for the change of the electrical dipole moment after transition from the ground to the Franck-Condon excited state.

Molecular ConformationAlkynechemistry.chemical_elementConjugated systemCrystallography X-RayPhotochemistryCatalysisMaterials ChemistryPhysics::Atomic PhysicsPhysics::Chemical Physicschemistry.chemical_classificationQuantitative Biology::BiomoleculesChemistryMetals and AlloysGeneral ChemistryTriple bondAmidesAcceptorSurfaces Coatings and FilmsElectronic Optical and Magnetic MaterialsElectric dipole momentAlkynesIntramolecular forceExcited stateCeramics and CompositesSpectrophotometry Ultravioletsense organsCarbonChemical Communications
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Enantioselective zinc-mediated conjugate alkynylation of saccharin-derived 1-aza-butadienes

2020

The enantioselective 1,4-alkynylation of conjugated imines derived from saccharin with aryl- and alkyl-substituted terminal alkynes has been achieved. The reaction mediated by diethylzinc in the presence of a catalytic amount of a bis(hydroxy)malonamide chiral ligand provides the corresponding imines bearing a propargylic stereocenter with moderate yields and fair to excellent enantioselectivities.

Molecular Conformationchemistry.chemical_elementZincConjugated systemCrystallography X-RayLigandsCatalysisStereocenterchemistry.chemical_compoundSaccharinCompostos orgànicsMaterials ChemistryChemistryArylChiral ligandMetals and AlloysEnantioselective synthesisStereoisomerismGeneral ChemistryDiethylzincCombinatorial chemistrySurfaces Coatings and FilmsElectronic Optical and Magnetic MaterialsZincCeramics and CompositesIminesQuímica orgànicaConjugateChemical Communications
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Monitoring the formation of biosilica catalysed by histidine-tagged silicatein.

2004

Surface bound silicatein retains its biocatalytic activity, which was demonstrated by monitoring the immobilisation of silicatein using a histidine-tag chelating anchor and the subsequent biosilicification of SiO(2) on surfaces by surface plasmon resonance spectroscopy, atomic force microscopy and scanning electron microscopy.

Molecular StructureAtomic force microscopyChemistryMetals and AlloysNanotechnologyGeneral ChemistryHistidine MetabolismSurface Plasmon ResonanceMicroscopy Atomic ForceSilicon DioxideCathepsinsCatalysisSurfaces Coatings and FilmsElectronic Optical and Magnetic MaterialsMicroscopyMaterials ChemistryCeramics and CompositesBiophysicsMicroscopy Electron ScanningMoleculeChelationHistidineSurface plasmon resonanceSurface plasmon resonance spectroscopyHistidineChemical communications (Cambridge, England)
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Is the special pair structure a good strategy for the kinetics during the last step of the energy transfer with the nearest antenna? A chemical model…

2013

A cofacial bis(Mg(II)porphyrin)-C(6)H(4)-free base ([Mg(2)]-bridge-FB) dyad shows S(1) energy transfer in both directions and much slower rates than similar monoporphyrin systems are observed.

Molecular StructureMetalloporphyrinsEnergy transferKineticsMetals and AlloysStructure (category theory)General ChemistryPorphyrinMolecular physicsCatalysisSurfaces Coatings and FilmsElectronic Optical and Magnetic MaterialsBase (group theory)chemistry.chemical_compoundKineticsZincchemistryEnergy TransferModels ChemicalComputational chemistryMaterials ChemistryCeramics and CompositesMoleculeMagnesiumAntenna (radio)Chemical communications (Cambridge, England)
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Structure of the 5′ untranslated region in SARS-CoV-2 genome and its specific recognition by innate immune systemviathe human oligoadenylate synthase…

2022

2′-5′-Oligoadenylate synthetase 1 (OAS1) is one of the key enzymes driving the innate immune system response to SARS-CoV-2 infection whose activity has been related to COVID-19 severity. OAS1 is a sensor of endogenous RNA that triggers the 2′-5′-oligoadenylate/RNase L pathway. Upon SARS-CoV-2 infection, OAS1 is responsible for the recognition of viral RNA and has been shown to possess a particularly high sensitivity for the 5′-untranslated (5′-UTR) RNA region, which is organized in a double-strand stem loop motif (SL1). Here we report the structure of the SL1/OAS1 complex also rationalizing the high affinity for OAS1.

Molecular dynamicSettore CHIM/03 - Chimica Generale E InorganicaSARS-CoV-2 infectionMaterials ChemistryMetals and AlloysCeramics and CompositesRNAGeneral Chemistrybiochemical phenomena metabolism and nutrition2′-5′-Oligoadenylate synthetase 1CatalysisSurfaces Coatings and FilmsElectronic Optical and Magnetic MaterialsChemical Communications
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Boolean operations mediated by an ion-pair receptor of a multi-readout molecular logic gate

2013

A heteroditopic BODIPY dye that performs all basic Boolean operations with a cation (K+) and an anion (F-) as inputs and absorption, transmission and fluorescence as outputs is described. The molecular logic gate can also act as a digital comparator between the inputs.

Molecular logic gateMetal-IonsAnalytical chemistryTopologyCatalysisIonchemistry.chemical_compoundComplexDrivenMaterials ChemistryKeypad LockCrown EtherFluorescence EnhancementChemistryMetals and AlloysGeneral ChemistryIon pairsFluorescenceSurfaces Coatings and FilmsElectronic Optical and Magnetic MaterialsRecognitionTransmission (telecommunications)Ceramics and CompositesDigital comparatorInputsBoolean operations in computer-aided designBODIPY
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