Search results for "Modelling"

showing 10 items of 1353 documents

Indicaxanthin, a multi-target natural compound from Opuntia ficus-indica fruit: From its poly-pharmacological effects to biochemical mechanisms and m…

2019

Abstract Over the latest years phytochemical consumption has been associated to a decreased risk of both the onset and the development of a number of pathological conditions. In this context indicaxanthin, a betalain pigment from Opuntia ficus-indica fruit, has been the object of sound research. Explored, at first, for its mere antioxidant potential, Indicaxanthin is now regarded as a redox-active compound able to exert significant poly-pharmacological effects against several targets in a number of experimental conditions both in vivo and in vitro. This paper aims to provide an overview on the therapeutical effects of indicaxanthin, ranging from the anti-inflammatory to the neuro-modulatory…

Models MolecularPyridinesOpuntia ficusPhytochemicalsContext (language use)Antioxidant potential01 natural sciencesMiceStructure-Activity Relationship03 medical and health scienceschemistry.chemical_compoundMulti targetCell Line TumorNeoplasmsSettore BIO/10 - BiochimicaBetalainDrug DiscoveryAnimalsHumansCell Proliferation030304 developmental biologyInflammationIndicaxanthin Multi-target compound Poly-pharmacology Antioxidant Antiinflammatory Antitumoral Antiproliferative Neuromodulator Molecular modellingPharmacologyBiological Products0303 health sciencesDose-Response Relationship DrugMolecular StructureTraditional medicine010405 organic chemistryNatural compoundOrganic ChemistryOpuntiaGeneral MedicineAntineoplastic Agents PhytogenicSettore CHIM/08 - Chimica FarmaceuticaBetaxanthins0104 chemical sciencesMice Inbred C57BLNeuroprotective AgentsPhytochemicalchemistryBlood-Brain BarrierFruitDrug Screening Assays AntitumorIndicaxanthinEuropean Journal of Medicinal Chemistry
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A3 adenosine receptor: Homology modeling and 3D-QSAR studies

2012

Adenosine receptors (AR) belong to the superfamily of G-protein-coupled receptors (GPCRs). They are divided into four subtypes (A1, A2A, A2B, and A3) [1], and can be distinguished on the basis of their distinct molecular structures, distinct tissues distribution, and selectivity for adenosine analogs [2,3]. The hA3R, the most recently identified adenosine receptor, is involved in a variety of intracellular signaling pathways and physiological functions [4]. Expression of A3R was reported to be elevated in cancerous tissues [5], and A3 antagonists have been proposed for therapeutic treatments of cancer. The recent literature availability of crystal structure of hA2A adenosine receptor (PDB c…

Models MolecularQuantitative structure–activity relationshipReceptor Adenosine A2AAdenosine A3 Receptor AntagonistsQuantitative Structure-Activity RelationshipComputational biologyBiologyPharmacologyDrug DiscoveryMolecular dynamics simulationMaterials ChemistrymedicineHumansAmino Acid SequenceHomology modelingPhysical and Theoretical ChemistryReceptorA3 INHIBITORS HOMOLOGY MODELING 3D-QSARSpectroscopyG protein-coupled receptorA3 ReceptorBinding SitesTriazinesReceptor Adenosine A3Intracellular Signaling Peptides and ProteinsTriazolesA3 ADENOSINE RECEPTORComputer Graphics and Computer-Aided DesignAdenosine receptorAdenosineSettore CHIM/08 - Chimica FarmaceuticaPharmacophoresHomology modellingPharmacophoreProtein Bindingmedicine.drug
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Modelling the enantioresolution capability of cellulose tris(3,5-dichlorophenylcarbamate) stationary phase in reversed phase conditions for neutral a…

2018

[EN] To the best of our knowledge, the prediction of the enantioresolution ability of polysaccharides-based stationary phases in liquid chromatography for structurally unrelated compounds has not been previously reported. In this study, structural information of neutral and basic compounds is used to model their enantioresolution levels obtained from an immobilised cellulose tris(3,5-dichlorophenylcarbamate) stationary phase in reversed phase conditions. Thirty-four structurally unrelated chiral drugs and pesticides, from seven families, are studied. Categorical enantioresolution levels (RsC, 0 = no baseline enantioresolution and 1 = baseline enantioresolution) are established from the expe…

Models MolecularTrisPhenylcarbamatesEnantioresolution modelling01 natural sciencesBiochemistryAnalytical Chemistrychemistry.chemical_compoundMolecular descriptorPhase (matter)Tris(35-dichlorophenylcarbamate)MoleculeLeast-Squares AnalysisPesticidesCelluloseCelluloseChromatography High Pressure LiquidReversed phase liquid chromatographyEnantioseparationsChromatography Reverse-PhasePrincipal Component AnalysisChromatography010405 organic chemistry010401 analytical chemistryOrganic ChemistryDiscriminant partial least squaresDiscriminant AnalysisStereoisomerismGeneral MedicineReversed-phase chromatography0104 chemical scienceschemistryStationary phaseAsymmetric carbonStationary phaseJournal of Chromatography A
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Statistical Analysis of Biological Models with Uncertainty

2020

In this contribution relevant biological models, based on random differential equations, are studied. For the sake of generality, we assume that the initial condition and the biological model parameters are dependent random variables with arbitrary probability distributions. We present a general methodology that enables us to provide a full probabilistic description of the solution stochastic process for each stochastic model. The statistical analysis is performed through the calculation of the first probability function by applying the random variable transformation technique. From the first probability density function, we can calculate any one-dimensional moment of the solution, includin…

Moment (mathematics)Stochastic modellingStochastic processProbabilistic logicApplied mathematicsProbability distributionInitial value problemProbability density functionRandom variableMathematics
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Metadata-Oriented Language Model in Translingual Retrieval of Digital Data

2015

Translingual retrieval relies on processing a source language to retrieve digital document content in a target language. From the perspective of successful browsing digital catalogues, probability of retrieving the full text document in a language other than the query language is close to zero owning to the fact that it is not only the library collection, but especially a problem of matching the index terms with the query keywords which are assumed to be their translation equivalents. In addition, hardly any digital library system is incorporated with a translation component. As a result, such a matching is rather coincidental. Our approach to the translingual document retrieval problem is …

Multilingual Digital LibrariesInformation retrievalComputer sciencebusiness.industryInformationSystems_INFORMATIONSTORAGEANDRETRIEVALLanguage Modellingcomputer.software_genreQuery languageCross-Language Information RetrievalQuery expansionUniversal Networking LanguageComputingMethodologies_DOCUMENTANDTEXTPROCESSINGData control languageLanguage modelArtificial intelligenceDocument retrievalbusinesscomputerNatural language processingCross-language information retrievalRDF query languagecomputer.programming_language
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The Multiscale Stochastic Model of Fractional Hereditary Materials (FHM)

2013

Abstract In a recent paper the authors proposed a mechanical model corresponding, exactly, to fractional hereditary materials (FHM). Fractional derivation index 13 E [0,1/2] corresponds to a mechanical model composed by a column of massless newtonian fluid resting on a bed of independent linear springs. Fractional derivation index 13 E [1/2, 1], corresponds, instead, to a mechanical model constituted by massless, shear-type elastic column resting on a bed of linear independent dashpots. The real-order of derivation is related to the exponent of the power-law decay of mechanical characteristics. In this paper the authors aim to introduce a multiscale fractance description of FHM in presence …

Multiscale FractanceRandom modelsStochastic modellingMathematical analysisModel parametersGeneral MedicineFractional HereditarinessDashpotFractional calculusMassless particleFractional DerivativesFractional Derivatives; Fractional Hereditariness; Multiscale Fractance; Random modelsFractional HereditarineCalculusExponentNewtonian fluidLinear independenceFractional DerivativeMathematicsProcedia IUTAM
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two-scale three-dimensional boundary element framework for degradation and failure in polycrystalline materials

2014

A fully three-dimensional two-scale boundary element approach to degradation and failure in polycrystalline materials is proposed. The formulation involves the engineering component level (macroscale) and the material grain scale (micro-scale). The damage-induced local softening at the macroscale is modelled employing an initial stress approach. The microscopic degradation processes are explicitly modelled by associating Representative Volume Elements (RVEs) to relevant points of the macro continuum and employing a three-dimensional grain-boundary formulation to simulate intergranular degradation and failure in the microstructural Voronoi-type morphology through cohesive-frictional contact …

Multiscale modellingPolycrystalline materialNon-linear boundary element method.Settore ING-IND/04 - Costruzioni E Strutture AerospazialiMicromechanic
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Global, regional, and national burden of mortality associated with non-optimal ambient temperatures from 2000 to 2019: a three-stage modelling study

2021

Background: Exposure to cold or hot temperatures is associated with premature deaths. We aimed to evaluate the global, regional, and national mortality burden associated with non-optimal ambient temperatures. Methods: In this modelling study, we collected time-series data on mortality and ambient temperatures from 750 locations in 43 countries and five meta-predictors at a grid size of 0·5° × 0·5° across the globe. A three-stage analysis strategy was used. First, the temperature–mortality association was fitted for each location by use of a time-series regression. Second, a multivariate meta-regression model was built between location-specific estimates and meta-predictors. Finally, the gri…

Multivariate statisticsHot TemperatureHealth (social science)Grid sizeMedicine (miscellaneous)mortality ratemedical researchtemperature mortalityBackground exposureGE1-350residentBurden of MortalityAmbient temperature610 Medicine & healthThree stageHealth PolicyMortality rateadultpublic healthTemperaturearticlePublic Health Global Health Social Medicine and EpidemiologyCold TemperatureGeographyfemaleModelling Studyweatherenvironmental temperatureAvaliação do Risco360 Social problems & social servicesNon-optimal Ambient TemperaturesAsiaClimate Change610 Medicine & healthEastern Europemale360 Social problems & social servicescontrolled studyhumanMortalityNational healthAustraliaPublic Health Environmental and Occupational Healthmajor clinical studyEnvironmental sciencesPremature deathFolkhälsovetenskap global hälsa socialmedicin och epidemiologiAfrica south of the SaharaResearch counciltime series analysiscold stressheatDeterminantes da Saúde e da DoençaDemography
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A discrete mathematical model for addictive buying: Predicting the affected population evolution

2011

This paper deals with the construction of a discrete mathematical model for addictive buying. Firstly, identifications of consumers buying behavior are performed by using multivariate statistical techniques based on real data bases and sociological approaches. Then the population is divided into appropriate groups according to the level of overbuying and a discrete compartmental model is constructed. The future short term addicted population is computed assuming several future economic scenarios. © 2010 Elsevier Ltd.

Multivariate statisticsMultivariate analysismedia_common.quotation_subjectPopulationMultivariant analysisAddictive buyingPopulation evolutionModelling and SimulationShort termEconometricsBuying behavioreducationmedia_commonDiscrete mathematical modeleducation.field_of_studyMathematical modelsMathematical modelAddictionModelingPopulation evolutionMultivariate statisticsCompartmental modelComputer Science ApplicationsTerm (time)Modeling and SimulationMultivariate statistical techniquesMultivariate statisticalMATEMATICA APLICADACompulsive buying
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Statistical Techniques for Validation of Simulation and Analytic Stochastic Models

2014

In this paper, we consider the problem of statistical validation of multivariate stationary response simulation and analytic stochastic models of observed systems (say, transportation or service systems), which have p response variables. The problem is reduced to testing the equality of the mean vectors for two multivariate normal populations. Without assuming equality of the covariance matrices, it is referred to as the Behrens–Fisher problem. The main purpose of this paper is to bring to the attention of applied researchers the satisfactory tests that can be used for testing the equality of two normal mean vectors when the population covariance matrices are unknown and arbitrary. To illus…

Multivariate statisticsService (systems architecture)education.field_of_studyStochastic modellingStatistical validationPopulationApplied mathematicsMultivariate normal distributionCovarianceeducationStatistical hypothesis testingMathematics
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