Search results for "Molecules"

showing 10 items of 1147 documents

Rapid self-healing and anion selectivity in metallosupramolecular gels assisted by fluorine-fluorine interactions.

2017

Simple ML2 [M = Fe(II), Co(II), Ni(II)] complexes obtained from a perfluoroalkylamide derivative of 4-aminophenyl-2,2′,6,2′-terpyridine spontaneously, yet anion selectively, self-assemble into gels, which manifest an unprecedented rapid gel strength recovery, viz. self-healing, and thermal rearrangement in aqueous dimethyl sulfoxide. The key factor for gelation and rheological properties emerges from the fluorine–fluorine interactions between the perfluorinated chains, as the corresponding hydrocarbon derivative did not form metallogels. The perfluoro-terpyridine ligand alone formed single crystals, while its Fe(II), Co(II) or Ni(II) complexes underwent rapid gelation leading to highly enta…

kemiachemistry.chemical_element02 engineering and technology010402 general chemistrychemistry01 natural sciencesMetalInorganic Chemistrychemistry.chemical_compoundTheoretical and Computational ChemistryfluorinePolymer chemistryOrganic chemistryThermal stabilitymoleculeshydrocarbonsta116chemistry.chemical_classificationgeelitAqueous solutionta114Ligandmolekyylit021001 nanoscience & nanotechnologygelsfluorihiilivedyt0104 chemical sciencesHydrocarbonchemistryvisual_artFluorinevisual_art.visual_art_mediumInorganic & Nuclear Chemistry0210 nano-technologySelectivityOther Chemical SciencesDerivative (chemistry)
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FTIR matrix isolation and theoretical studies of glycolic acid dimers

2018

Glycolic acid (GA) dimers were studied in low temperature argon matrices by means of FTIR spectroscopy. Experimentally, the dimers were produced when monomeric glycolic acid molecules were thermally mobilized upon annealing of argon matrices at 25–35 K. The experimental spectra observed upon annealing indicate the presence of three different dimer structures. Computationally, MP2 and DFT calculations were used to study the potential dimer species in order to scrutinize the possible dimer structures, their energetics and their spectral features. Altogether 27 local minima were found for dimer structures for the three lowest conformers of glycolic acid considered based on previous studies on …

kemiaeristysspectraDimerinfrared spectrahapotInfrared spectroscopy02 engineering and technologychemistry010402 general chemistryDFT01 natural sciencesAnalytical ChemistryInorganic Chemistryglycolchemistry.chemical_compoundPhysics::Atomic and Molecular ClustersMoleculePhysics::Chemical Physicsta116Conformational isomerismacidsSpectroscopyGlycolic acidQuantitative Biology::Biomoleculesvetysidokseteristys (eristäminen muista)MP2Hydrogen bondOrganic ChemistryMatrix isolation021001 nanoscience & nanotechnology0104 chemical sciencesspektritMonomerchemistryvetyhydrogenhydrogen bondsglykoliargonPhysical chemistry0210 nano-technologyisolationJournal of Molecular Structure
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Identifying Vibrations that Control Non-adiabatic Relaxation of Polaritons in Strongly Coupled Molecule-Cavity Systems

2022

The strong light–matter coupling regime, in which excitations of materials hybridize with excitations of confined light modes into polaritons, holds great promise in various areas of science and technology. A key aspect for all applications of polaritonic chemistry is the relaxation into the lower polaritonic states. Polariton relaxation is speculated to involve two separate processes: vibrationally assisted scattering (VAS) and radiative pumping (RP), but the driving forces underlying these two mechanisms are not fully understood. To provide mechanistic insights, we performed multiscale molecular dynamics simulations of tetracene molecules strongly coupled to the confined light modes of an…

kytkentäenergiavärähtelytcavitiesGeneral Materials SciencemoleculesmolekyylitPhysical and Theoretical Chemistryoscillationnonadiabatic couplingenergy
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Large Azobenzene Macrocycles : Formation and Detection by NMR and MS Methods

2023

Azobenzene macrocycles are widely investigated as potential drug delivery systems and as part of molecular machines due to their photo-responsive properties. Herein, we detect the formation of a series of new azobenzene macrocycles that feature up to eight switchable repeating units. High-resolution mass spectrometry and ion mobility (IM) mass spectrometry experiments and 1H and diffusion-ordered spectroscopy (DOSY) NMR are used to detect the presence of the macrocycles that contain 10 to 40 aromatic rings in the gas phase and solution, respectively. The responsiveness of the Z-to-E photo-switching of the smallest of the macrocycles, exhibiting two azobenzene units and in total 10 aromatic …

large azobenzene-containing macrocyclesresponsive moleculesmassaspektrometriaspektroskopiaatsobentseeniphotoisomerizationmolekyylitmakrosyklitESI-MS and IM detection
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HLA-Class II Artificial Antigen Presenting Cells in CD4+ T Cell-Based Immunotherapy

2019

CD4+ T cells differentiate into various T helper subsets characterized by distinct cytokine secreting profiles that confer them effector functions adapted to a variety of infectious or endogenous threats. Regulatory CD4+ T cells are another specialized subset that plays a fundamental role in the maintenance of immune tolerance to self-antigens. Manipulating effector or regulatory CD4+ T cells responses is a promising immunotherapy strategy for, respectively, chronical viral infections and cancer, or severe autoimmune diseases and transplantation. Adoptive cell therapy (ACT) is an emerging approach that necessitates defining robust and efficient methods for the in vitro expansion of antigen-…

lcsh:Immunologic diseases. AllergyHLA class II moleculesautoimmunityartificial antigen presenting cellscanceradoptive cell therapyCD4+ T lymphocyteslcsh:RC581-607Frontiers in Immunology
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Glycosidopyrroles. Part 4. 1-β-D-ribofuranosyl-pyrroles and indoles as potential antiviral agents

2000

The preparation of new 1-β-D-ribofuranosylpyrroles of type 8 and a new method of synthesis of 1-β-D-ribofuranosylindoles of type 10, according to the scheme, is reported. All these new derivatives showed promising chemical and physical analogies with bioactive molecules but did not show any antiviral activity againstHIV1.

lcsh:QD241-441lcsh:Organic chemistryChemistryStereochemistryBioactive moleculesOrganic ChemistryCombinatorial chemistry
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Nutritional and microbiological quality of tiger nut tubers (Cyperus esculentus), derived plant-based and lactic fermented beverages

2018

International audience; Tiger nut (Cyperus esculentus) is a tuber that can be consumed raw or processed into beverages. Its nutritional composition shows a high content of lipid and dietary fiber, close to those of nuts, and a high content of starch, like in other tubers. Tiger nuts also contain high levels of phosphorus, calcium, and phenolic compounds, which contribute to their antioxidant activity. From those characteristics, tiger nuts and derived beverages are particularly relevant to limit food insecurity in regions where the plant can grow. In Europe and United States, the tiger nut derived beverages are of high interest as alternatives to milk and for gluten-free diets. Fermentation…

lcsh:TP500-660[SDV.BIO]Life Sciences [q-bio]/Biotechnologydigestive oral and skin physiologyfungiOrxatalactic fermentationfood and beverages[SDV.BBM.BM]Life Sciences [q-bio]/Biochemistry Molecular Biology/Molecular biologylcsh:Fermentation industries. Beverages. Alcoholhorchata[SDV.BBM.BC]Life Sciences [q-bio]/Biochemistry Molecular Biology/Biomolecules [q-bio.BM]tiger nutsbeveragequality[SDV.IDA]Life Sciences [q-bio]/Food engineeringsense organs[SDV.BBM.BC]Life Sciences [q-bio]/Biochemistry Molecular Biology/Biochemistry [q-bio.BM]product development[SDV.AEN]Life Sciences [q-bio]/Food and NutritionNutricióProductes lactis
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Design, Synthesis and Characterization of a Visible-Light-Sensitive Molecular Switch and Its PEGylation Towards a Self-Assembling Molecule.

2022

HBDI-like chromophores represent a novel set of biomimetic switches mimicking the fluorophore of the green fluorescent protein that are currently studied with the hope to expand the molecular switch/motor toolbox. However, until now members capable of absorbing visible light in their neutral (i. e. non-anionic) form have not been reported. In this contribution we report the preparation of an HBDI-like chromophore based on a 3-phenylbenzofulvene scaffold capable of absorbing blue light and photoisomerizing on the picosecond timescale. More specifically, we show that double-bond photoisomerization occurs in both the E-to-Z and Z-to-E directions and that these can be controlled by irradiating …

light-driven molecular switchesnanoaggregatesHBDI-like chromophores; light-driven molecular switches; light-sensitive molecules; nanoaggregates; photoswitches; self-assembling molecules; Green Fluorescent Proteins; LightLightOrganic ChemistryGreen Fluorescent ProteinsHBDI-like chromophoresself-assembling moleculesGeneral Chemistrylight-sensitive moleculesCatalysisphotoswitchesChemistry (Weinheim an der Bergstrasse, Germany)
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Extracellular Vesicles as Biological Shuttles for Targeted Therapies.

2019

The development of effective nanosystems for drug delivery represents a key challenge for the improvement of most current anticancer therapies. Recent progress in the understanding of structure and function of extracellular vesicles (EVs)—specialized membrane-bound nanocarriers for intercellular communication—suggests that they might also serve as optimal delivery systems of therapeutics. In addition to carrying proteins, lipids, DNA and different forms of RNAs, EVs can be engineered to deliver specific bioactive molecules to target cells. Exploitation of their molecular composition and physical properties, together with improvement in bio-techniques to modify their content are critical iss…

liposomesMolecular compositionBioactive moleculesReviewExtracellular vesiclesCatalysislcsh:ChemistryInorganic Chemistry03 medical and health sciencesExtracellular Vesicles0302 clinical medicineDrug Delivery SystemsPlant-derived extracellular vesicleAnimalsHumanstarget therapiesTarget therapyPhysical and Theoretical ChemistryRNA Small Interferinglcsh:QH301-705.5Molecular BiologySpectroscopy030304 developmental biology0303 health sciencesDrug CarriersChemistryOrganic ChemistryGeneral MedicinePlantsComputer Science ApplicationsStructure and functionCell biologyLiposomeplant-derived extracellular vesicleslcsh:Biology (General)lcsh:QD1-999Pharmaceutical Preparations030220 oncology & carcinogenesisDrug deliverydrug deliveryExtracellular vesicleNanocarriersDrug carrierInternational journal of molecular sciences
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Experimental evidence for a liquid-liquid crossover in deeply cooled confined water.

2014

International audience; In this work we investigate, by means of elastic neutron scattering, the pressure dependence of mean square displacements (MSD) of hydrogen atoms of deeply cooled water confined in the pores of a three-dimensional disordered SiO 2 xerogel; experiments have been performed at 250 and 210 K from atmospheric pressure to 1200 bar. The " pressure anomaly " of supercooled water (i.e., a mean square displacement increase with increasing pressure) is observed in our sample at both temperatures; however, contrary to previous simulation results and to the experimental trend observed in bulk water, the pressure effect is smaller at lower (210 K) than at higher (250 K) temperatur…

liquid-liquid transitionPhase transitionPACS: 64.70.Ja 64.70.pm 25.40.DnMaterials scienceNeutron diffractionGeneral Physics and AstronomyThermodynamicsNeutron scatteringSettore FIS/03 - Fisica Della MateriaPhase TransitionNuclear magnetic resonanceWater Movementsglass transitionElastic neutron scattering[PHYS.COND]Physics [physics]/Condensed Matter [cond-mat]SupercoolingElastic neutron scattering; calorimetry; glass transition; liquid-liquid transitionAtmospheric pressure[SDV.BBM.BS]Life Sciences [q-bio]/Biochemistry Molecular Biology/Structural Biology [q-bio.BM]Calorimetry Differential ScanningWaterSilicon DioxideSettore FIS/07 - Fisica Applicata(Beni Culturali Ambientali Biol.e Medicin)Cold Temperature[SDV.BBM.BS]Life Sciences [q-bio]/Biochemistry Molecular Biology/Biomolecules [q-bio.BM]Neutron DiffractionModels ChemicalGlass transitioncalorimetryHydrophobic and Hydrophilic InteractionsAmbient pressureBar (unit)HydrogenPhysical review letters
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