Search results for "PREDICT"

showing 10 items of 2174 documents

New zeolite-like RUB-5 and its related hydrous layer silicate RUB-6 structurally characterized by electron microscopy.

2020

RUB-5 and its related hydrous layer silicate RUB-6 were synthesized in the 1990s, but so far their structures have remained unknown due to their low crystallinity and disorder. The combination of 3D electron diffraction, X-ray powder diffraction, high-resolution transmission electron microscopy, structural modelling and diffraction simulations has enabled a comprehensive description of these two nanomaterials, revealng a new framework topology and a unique silica polymorph.

DiffractionMaterials sciencecomputational modellingStackinginorganic materials02 engineering and technology010402 general chemistry01 natural sciencesBiochemistrydiffuse scatteringMetalexit wave reconstructionchemistry.chemical_compoundpolymorph predictionframework-structured solidsGeneral Materials ScienceZeolitelcsh:Sciencestacking faultsElectron crystallographymicroporous materialsGeneral Chemistry021001 nanoscience & nanotechnologyCondensed Matter PhysicsResearch PapersNanocrystalline materialSilicate3D electron diffraction0104 chemical sciencesSilanolCrystallographyelectron crystallographychemistryvisual_artvisual_art.visual_art_mediumlcsh:Q0210 nano-technologyIUCrJ
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A Digital Twin predictive maintenance framework of air handling units based on automatic fault detection and diagnostics

2022

The building industry consumes the most energy globally, making it a priority in energy efficiency initiatives. Heating, ventilation, and air conditioning (HVAC) systems create the heart of buildings. Stable air handling unit (AHU) functioning is vital to ensuring high efficiency and extending the life of HVAC systems. This research proposes a Digital Twin predictive maintenance framework of AHU to overcome the limitations of facility maintenance management (FMM) systems now in use in buildings. Digital Twin technology, which is still at an initial stage in the facility management industry, use Building Information Modeling (BIM), Internet of things (IoT) and semantic technologies to create…

Digita twinsDigita twinInternet of thingsAir handling unit performance assessment rulesMechanical EngineeringPredictive maintenanceBuilding and ConstructionVDP::Teknologi: 500Air handling unitAPARFacility managementElectrical and Electronic EngineeringAir handling unitsCivil and Structural Engineering
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A new solver for incompressible non-isothermal flows in natural and mixed convection over unstructured grids

2022

Abstract In the present paper we propose a new numerical methodology for the solution of 2D non-isothermal incompressible flows for natural and mixed convection in irregular geometries. The governing equations are the Incompressible Navier-Stokes Equations and the Energy Conservation Equation. Fluid velocity and temperature are coupled in the buoyancy term of the momentum equations according to the Oberbeck–Boussinesq approximation. The governing equations are discretized over unstructured triangular meshes satisfying the Delaunay property. Thanks to the Oberbeck–Boussinesq hypothesis, the flow and energy problems are solved in an uncoupled way, and two fractional time step procedures are s…

DiscretizationDelaunay triangulationApplied MathematicsEulerian pathUnstructured meshesSolverNumerical methodSettore ICAR/01 - IdraulicaPhysics::Fluid Dynamicssymbols.namesakeMatrix (mathematics)Flow (mathematics)Natural convectionModeling and SimulationPredictor-corrector schemesymbolsApplied mathematicsIncompressible fluidMixed convectionCondition numberMathematicsNumerical stability
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Copolymerization of VDF and HFP in Supercritical Carbon Dioxide: A Robust Approach for Modeling Precipitation and Dispersion Kinetics

2012

A kinetic model is developed for the heterogeneous free-radical copolymerization of vinylidene fluoride and hexafluoropropylene in supercritical CO 2. The model accounts for polymerization in both the dispersed (polymer-rich) phase and in the continuous (polymer-free) supercritical phase, for radical interphase transport, diffusion limitations, and chain-length-dependent termination in the polymer-rich phase. A parameter evaluation strategy is developed and detailed to estimate most of the kinetic parameters a priori while minimizing their evaluation by direct fitting. The resulting model predictions compare favorably with the experimental results of conversion and MWD at varying monomer fe…

Dispersion kineticChain-length-dependent terminationDiffusionSupercritical carbon dioxideSupercritical phaseCopolymerCopolymerizationKineticRobust approacheHexafluoropropyleneModel predictionFree radical polymerizationFree radical copolymerizationKinetic modelPolymers Supercritical fluid extractionSettore ING-IND/27 - Chimica Industriale E TecnologicaDiffusion limitationFluorine containing polymerMonomerParameter evaluationVinylidene fluoride Carbon dioxideHeterogeneous polymerizationMonomer concentrationFeed compositionSupercritical COModel
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Impact of Noah-LSM Parameterizations on WRF Mesoscale Simulations: Case Study of Prevailing Summer Atmospheric Conditions over a Typical Semi-Arid Re…

2021

The current study evaluates the ability of the Weather Research and Forecasting Model (WRF) to forecast surface energy fluxes over a region in Eastern Spain. Focusing on the sensitivity of the model to Land Surface Model (LSM) parameterizations, we compare the simulations provided by the original Noah LSM and the Noah LSM with multiple physics options (Noah-MP). Furthermore, we assess the WRF sensitivity to different Noah-MP physics schemes, namely the calculation of canopy stomatal resistance (OPT_CRS), the soil moisture factor for stomatal resistance (OPT_BTR), and the surface layer drag coefficient (OPT_SFC). It has been found that these physics options strongly affect the energy partiti…

Drag coefficientsurface fluxesGeography Planning and DevelopmentMesoscale meteorologyTJ807-830Numerical weather predictionnumerical weather predictionManagement Monitoring Policy and LawSensible heatTD194-195Atmospheric sciencesRenewable energy sourcesLatent heatGE1-350Surface layerLand surface modelsland surface–atmosphere interactionsEnvironmental effects of industries and plantsRenewable Energy Sustainability and the EnvironmentSurface fluxesNoahFísica de la TierraLand surface–atmosphere interactionsNumerical weather predictionEnvironmental sciencesHeat fluxWRF modelWeather Research and Forecasting Modelland surface modelsTeoría de la Señal y ComunicacionesNoah-MPGeografia
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Predictive factors for sustained virological response after treatment with pegylated interferon α-2a and ribavirin in patients infected with HCV geno…

2014

BackgroundPrevious trials have often defined genotype 2 and 3 patients as an "easy to treat" group and guidelines recommend similar management.AimsThe present study looks for differences between the two genotypes and analyzes predictive factors for SVR.MethodsProspective, community-based cohort study involving 421 physicians throughout Germany. The analysis includes 2,347 patients with untreated chronic HCV genotype 2 (n = 391) and 3 (n = 1,956) infection treated with PEG-IFN α-2a plus ribavirin between August 2007 and July 2012.ResultsWhen compared with genotype 2 patients, those with genotype 3 were younger, had a shorter duration of infection, lower values of total cholesterol, LDL chole…

DrugAdultMalemedicine.medical_specialtyMultivariate analysisGenotypeGastroenterology and hepatologyHepacivirusmedia_common.quotation_subjectScienceHepacivirusGastroenterologyCohort Studieschemistry.chemical_compoundInternal medicineGermanyAlcohols Cholesterol; Dose prediction methods; Drug therapy; Fibrosis; Multivariate analysis; Physicians; Treatment guidelinesGenotypemedicineHumansLiver diseasesmedia_commonMedicine and health sciencesMultidisciplinarybiologybusiness.industryRibavirinQRHepatitis CMiddle Agedbiology.organism_classificationmedicine.diseaseHepatitis C3. Good healthClinical trialInfectious hepatitischemistryImmunologyMedicineFemalebusinessCohort studyResearch ArticlePloS one
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2015

Drug resistance still impedes successful cancer chemotherapy. A major goal of early concepts in individualized therapy was to develop in vitro tests to predict tumors' drug responsiveness. We have developed an in vitro short-term test based on nucleic acid precursor incorporation to determine clinical drug resistance. This test detects inherent and acquired resistance in vitro and transplantable syngeneic and xenografted tumors in vivo. In several clinical trials, clinical resistance was predictable with more than 90% accuracy, while drug sensitivity was detected with less accuracy (~60%). Remarkably, clinical cross-resistance to numerous drugs (multidrug resistance, broad spectrum resistan…

DrugCancer Researchbusiness.industrymedia_common.quotation_subjectDrug resistanceBioinformaticsMultiple drug resistanceClinical trialOncologyIn vivomedicineDoxorubicinPersonalized medicinePredictive testingbusinessmedia_commonmedicine.drugFrontiers in Oncology
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Covalent binding of drug metabolites to DNA ? a tool of predictive value?

1980

The presently available data suggest at least some correlation between covalent binding of drug metabolites to DNA and carcinogenicity of that drug. More data, however, are needed to establish the predictability of covalent DNA binding assays for extrahepatic cancer. A covalent binding assay requires administration of radioactively labelled compound to the experimental animals; the availability of labelled compound and requirements as to radiochemical purity, chemical and biochemical stability are limiting the applicability of this procedure. Many technical pitfalls accompany covalent DNA binding assays. It is concluded that at the present time DNA binding assays do not represent routine pr…

DrugHealth Toxicology and Mutagenesismedia_common.quotation_subjectLiver NeoplasmsDrug Evaluation PreclinicalCovalent bindingDNAGeneral MedicineIn Vitro TechniquesToxicologyPredictive valueMolecular biologyRatschemistry.chemical_compoundLiverchemistryBiochemistryCovalent bondCarcinogensAnimalsStandard testDNACarcinogenDrug metabolismmedia_commonArchives of Toxicology
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Detection of  9-Tetrahydrocannabinol and Amphetamine-Type Stimulants in Oral Fluid Using the Rapid Stat  Point-of-Collection Drug-Testing Device

2010

The Rapid Stat assay, a point-of-collection drug-testing device for detection of amphetamines, cannabinoids, cocaine, opiates, methadone, and benzodiazepines in oral fluid, was evaluated for cannabis and amphetamine-type stimulants. The Rapid Stat tests (n = 134) were applied by police officers in routine traffic checks. Oral fluid and blood samples were analyzed using gas chromatography-mass spectrometry (GC-MS) for Delta(9)-tetrahydrocannabinol, amphetamine, methamphetamine, methylenedioxymethamphetamine, methylenedioxyethylamphetamine, and methylenedioxyamphetamine. The comparison of GC-MS analysis of oral fluid with the Rapid Stat results for cannabis showed a sensitivity of 85%, a spec…

DrugMarijuana AbuseSalivaN-Methyl-34-methylenedioxyamphetamineHealth Toxicology and Mutagenesismedia_common.quotation_subjectmedicine.medical_treatmentAmphetamine-Related DisordersPharmacologyToxicologySensitivity and SpecificityGas Chromatography-Mass SpectrometryMethamphetamineAnalytical ChemistryPredictive Value of TestsmedicineHumansEnvironmental ChemistryFalse Positive ReactionsDronabinolSalivaAmphetamineFalse Negative Reactionsmedia_commonImmunoassayChemical Health and SafetyChromatographybiologyChemistryAmphetaminesSolid Phase ExtractionMethamphetaminebiology.organism_classificationSubstance Abuse DetectionAmphetamineCannabinoidCannabisGas chromatography–mass spectrometrymedicine.drugMethadoneJournal of Analytical Toxicology
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Rapid in vitro test to predict ocular tissue permeability based on biopartitioning micellar chromatography.

2003

The drug permeability prediction across the ocular tissues is important in the development of new drugs and drug delivery strategies. Physicochemical characteristics of drugs, mainly acid-base character, hydrophobicity and the molecular size determine both their transport across the eye tissue barriers and their retention in biopartitioning micellar chromatography (BMC). An in vitro model able to describe and predict the whole cornea drug permeability is proposed. The model uses the retention of drugs in BMC and molecular weight (MW) as predictive variables. The relationships between drug retention data in BMC and their bibliographic permeability values in stroma, epithelium-plus-stroma and…

DrugOctanolsIn vitro testChemical Phenomenamedia_common.quotation_subjectPharmaceutical ScienceEyeModels BiologicalPermeabilityCorneaOcular tissueDrug permeabilityPredictive Value of TestsCorneamedicinemedia_commonChromatography Micellar Electrokinetic CapillaryChromatographyDrug discoveryChemistryChemistry PhysicalPermeability (earth sciences)medicine.anatomical_structureData Interpretation StatisticalDrug deliveryIndicators and ReagentsSpectrophotometry UltravioletEuropean journal of pharmaceutical sciences : official journal of the European Federation for Pharmaceutical Sciences
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