Search results for "ALGORITHM"

showing 10 items of 4887 documents

Analysis of the sensitivity to the systematic error in least-squares regression models

2004

An algorithm that calculates the sensitivity to the systematic error of the fitted parameters of a least-squares regression model, with respect to the known parameters, is developed. The algorithm can be applied to mechanistic and empirical models, obtained by linear and non-linear regression, including principal component and partial least-squares. It can be useful in identifying those parameters or calibration regions that can influence other parameters and the response mostly, and thus, whose accuracy should be particularly procured. Other applications are the weighing of experimental points and the comparison of different models and regression methods in terms of its ability of amplifyi…

ChemistryCalibration (statistics)Regression analysisBiochemistryRegressionAnalytical ChemistryPrincipal component analysisLinear regressionStatisticsEnvironmental ChemistryErrors-in-variables modelsSensitivity (control systems)Nonlinear regressionAlgorithmSpectroscopyAnalytica Chimica Acta
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An algorithm based in Ewald's method to calculate lattice sums in the framework of crystal field theory

1992

A simple procedure to help calculate the electrostatic potential at any point inside an ionic crystal is proposed and tested. The rationale for the mathematical algorithm to calculate lattice sums is based on Ewald's technique. The method is discussed with regard to the dimensions and shape of the crystal lattice. Electrostatic potential for NaCl and MgO type structures are obtained and compared with the values calculated by means of Ewald's method

ChemistryCrystal chemistryCrystal structureCondensed Matter PhysicsBiochemistryP3MEwald summationCondensed Matter::Materials ScienceParticle in a one-dimensional latticeCrystal field theoryLattice (order)Ewald's spherePhysical and Theoretical ChemistryAlgorithmJournal of Molecular Structure: THEOCHEM
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Speciation analysis of food

2015

ChemistryEnvironmental chemistryGenetic algorithmBioavailability
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A review of non-chromatographic methods for speciation analysis.

2008

This manuscript overviews relevant scientific literature concerning speciation of trace elements by using non-chromatographic methods. The main principles of the different strategies proposed in the published works and their advantages and drawbacks are discussed in order to provide to the readers an appropriate picture of the state-of the-art of fast and cheap methodologies available to obtain information about the presence of different chemical forms of trace elements in environmental, clinical and food samples. A selection of the methods proposed for the speciation of the different elements studied was also provided together with their main features.

ChemistryGenetic algorithmEnvironmental ChemistryMineralogyBiochemical engineeringScientific literatureBiochemistrySpectroscopyAnalytical ChemistryTRACE (psycholinguistics)Analytica chimica acta
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Artificial neural network for quantitative determination of total protein in yogurt by infrared spectrometry

2009

Abstract A method has been introduced for quantitative determination of protein content in yogurt samples based on the characteristic absorbance of protein in 1800–1500 cm− 1 spectral region by mid-FTIR spectroscopy and chemometrics. Successive Projection Algorithm (SPA) wavelength selection procedure, coupled with feed forward Back-Propagation Artificial Neural Network (BP-ANN) model was the benefited chemometric technique. Relative Error of Prediction (REP) in BP-ANN and SPA-BP-ANN methods for training set was 7.25 and 3.70 respectively. Considering the complexity of the sample, the ANN model was found to be reliable, while the proposed method is rapid and simple, without any sample prepa…

ChemometricsAbsorbanceChromatographyArtificial neural networkChemistryApproximation errorSample preparationBiological systemQuantitative analysis (chemistry)SpectroscopyBackpropagationDykstra's projection algorithmAnalytical ChemistryMicrochemical Journal
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How diffusivity, thermocline and incident light intensity modulate the dynamics of Deep Chlorophyll Maximum in Tyrrhenian Sea

2015

During the last few years theoretical works have shed new light and proposed new hypotheses on the mechanisms which regulate the spatio-temporal behaviour of phytoplankton communities in marine pelagic ecosystems. Despite this, relevant physical and biological issues, such as effects of the time- dependent mixing in the upper layer, competition between groups, and dynamics of non-stationary deep chlorophyll maxima, are still open questions. In this work, we analyze the spatio-temporal behaviour of five phytoplankton populations in a real marine ecosystem by using a one-dimensional reaction-diffusion-taxis model. The study is performed, taking into account the seasonal variations of environm…

Chlorophyll0106 biological sciencesLight010504 meteorology & atmospheric sciencesMixed layerlcsh:MedicineOceanographyRandom processeAtmospheric sciences01 natural scienceschemistry.chemical_compoundPhytoplanktonMediterranean SeaMarine ecosystemSpatial ecologySeawaterMarine ecosystem14. Life underwaterPhytoplankton dynamiclcsh:Science0105 earth and related environmental sciencesDeep chlorophyll maximumMultidisciplinaryEcology010604 marine biology & hydrobiologylcsh:RTemperaturePelagic zoneModels TheoreticalSpatial ecology; Marine ecosystems; Phytoplankton dynamics; Deep chlorophyll maximum; Random processes; Stochastic differential equationsSettore FIS/07 - Fisica Applicata(Beni Culturali Ambientali Biol.e Medicin)Light intensitychemistry13. Climate actionChlorophyllPhytoplanktonStochastic differential equationsDeep chlorophyll maximumEnvironmental sciencelcsh:QThermoclineAlgorithmsResearch Article
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Gaussian processes retrieval of leaf parameters from a multi-species reflectance, absorbance and fluorescence dataset.

2013

Abstract: Biochemical and structural leaf properties such as chlorophyll content (Chl), nitrogen content (N), leaf water content (LWC), and specific leaf area (SLA) have the benefit to be estimated through nondestructive spectral measurements. Current practices, however, mainly focus on a limited amount of wavelength bands while more information could be extracted from other wavelengths in the full range (400-2500 nm) spectrum. In this research, leaf characteristics were estimated from a field-based multi-species dataset, covering a wide range in leaf structures and Chl concentrations. The dataset contains leaves with extremely high Chl concentrations (>100 mu g cm(-2)), which are seldom es…

ChlorophyllSpecific leaf areaNitrogenBiophysicsRed edgeTreesAbsorbancesymbols.namesakeRadiology Nuclear Medicine and imagingGaussian processWater contentBiologyRemote sensingMathematicsRadiationRadiological and Ultrasound TechnologyPhysicsHyperspectral imagingWaterRegression analysisPlant LeavesChemistrySpectrometry FluorescencesymbolsCurve fittingAlgorithmsJournal of photochemistry and photobiology. B, Biology
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A computer program suitable for analysis of choice of categories in biomedical data recognition problems.

1980

The optimum choice of categories in problems of medical data recognition is governed by the choice of categories, the selection of appropriate features, and by the choice of a loss function. Under these circumstances it is often difficult to find out the suitable classification scheme. The computer program described here serves for the design of the optimum recognition procedure. The Bayes rule is used as decision rule. A criterion for the comparison of different choice of categories is given. The program can be performed after estimation of the underlying prior probabilities and the conditional densities obtained from a training set, and before testing the decision rule with real data.

Choice setComputer programComputer sciencebusiness.industryComputersDecision theoryMedicine (miscellaneous)Decision ruleFunction (mathematics)Machine learningcomputer.software_genreClassificationBayes' theoremDecision TheoryBiomedical dataResearch DesignData miningArtificial intelligencebusinesscomputerSelection (genetic algorithm)Computer programs in biomedicine
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An Optimized Design of Choice Experiments: A New Approach for Studying Decision Behavior in Choice Task Experiments

2014

In this paper, we present a new approach for the optimal experimental design problem of generating diagnostic choice tasks, where the respondent's decision strategy can be unambiguously deduced from the observed choice. In this new approach, we applied a genetic algorithm that creates a one-to-one correspondence between a set of predefined decision strategies and the alternatives of the choice task; it also manipulates the characteristics of the choice tasks. In addition, this new approach takes into account the measurement errors that can occur when the preferences of the decision makers are being measured. The proposed genetic algorithm is capable of generating diagnostic choice tasks eve…

Choice setOperationalizationSociology and Political Sciencebusiness.industryComputer scienceStrategy and ManagementGeneral Decision SciencesContrast (statistics)Space (commercial competition)Machine learningcomputer.software_genreTask (project management)Arts and Humanities (miscellaneous)Similarity (psychology)Genetic algorithmArtificial intelligenceSet (psychology)businesscomputerApplied PsychologyJournal of Behavioral Decision Making
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Automatic detection of large dense-core vesicles in secretory cells and statistical analysis of their intracellular distribution.

2010

Analyzing the morphological appearance and the spatial distribution of large dense-core vesicles (granules) in the cell cytoplasm is central to the understanding of regulated exocytosis. This paper is concerned with the automatic detection of granules and the statistical analysis of their spatial locations in different cell groups. We model the locations of granules of a given cell as a realization of a finite spatial point process and the point patterns associated with the cell groups as replicated point patterns of different spatial point processes. First, an algorithm to segment the granules using electron microscopy images is proposed. Second, the relative locations of the granules with…

Chromaffin CellsInformation Storage and RetrievalBiologyBioinformaticsModels BiologicalSensitivity and SpecificityPoint processExocytosislaw.inventionPattern Recognition AutomatedMicelawArtificial IntelligenceImage Interpretation Computer-AssistedGeneticsAnimalsSecretionChromaffin GranulesComputer SimulationCells CulturedModels StatisticalApplied MathematicsVesicleSecretory VesiclesReproducibility of ResultsImage EnhancementEmpirical distribution functionMicroscopy ElectronAnimals NewbornCytoplasmData Interpretation StatisticalElectron microscopeBiological systemIntracellularAlgorithmsBiotechnologyIEEE/ACM transactions on computational biology and bioinformatics
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