224 resultados para Previsão com Metodologia de Box-Jenkins


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Este trabalho demonstra os resultados preliminares, parciais, da experimentação e aceitação de uma metodologia para apresentação de imagens médicas, que utiliza programas simples, sem custo por serem "freewares", que podem ser utilizados em plataformas computacionais medianas, normalmente subutilizadas, não sendo necessários programas extensos, de alto custo, aprendizado dificultado pela sofisticação, tornando mais simples e acessível a possibilidade de visualização, apresentação, impressão, documentação, arquivamento, transmissão eletrônica e disponibilidade para consulta de uma gama de imagens médicas.

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OBJETIVO: A análise crítica da metodologia de medida da camada semi-redutora em feixes de raios X teve como base o regulamento técnico para proteção radiológica e controle de qualidade em radiodiagnóstico médico e odontológico. MATERIAIS E MÉTODOS: Na medida da camada semi-redutora, a técnica radiográfica, o arranjo experimental, os meios espalhadores, a instrumentação, o tamanho de campo de radiação e a metodologia de análise dos dados foram considerados. RESULTADOS: A camada semi-redutora obtida em condições de boa geometria, para a técnica escolhida, foi de 2,44 ± 0,02 mmAl. Em relação a este valor, observaram-se desvios máximos na camada semi-redutora de 4,1% na variação da geometria, de 98,8% na variação da câmara de ionização e do meio espalhador, e de até 29,5% com outro tipo de detector. CONCLUSÃO: Os resultados mostraram que não ocorre variação significante na camada semi-redutora para diferentes tamanhos de campo de radiação, mas foram evidentes a influência do espalhamento na superestimação da camada semi-redutora e a redução desta na presença de blocos de chumbo como meio espalhador. O procedimento prático adotado mostrou-se bastante confiável e evidenciou a grande discrepância decorrente da adoção de metodologias impróprias, enfatizando a necessidade de estabelecer um procedimento padrão para a medida da camada semi-redutora.

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OBJETIVO: Diferentes métodos são usados para determinar atividade do radioiodo para tratamento de hipertireoidismo (doença de Graves). Alguns não consideram a dose absorvida pela tireóide ou os parâmetros necessários para este cálculo. A relação entre dose absorvida e atividade administrada depende da meia-vida efetiva, da captação do iodo e da massa da tireóide de cada paciente. O objetivo deste trabalho é propor uma metodologia para tratamento individualizado com 131I em pacientes portadores de hipertireoidismo da doença de Graves. MATERIAIS E MÉTODOS: Usou-se um simulador de tireóide-pescoço desenvolvido no Instituto de Radioproteção e Dosimetria contendo solução de 131I, para calibração da gama-câmara e sonda cintilométrica do Serviço de Medicina Nuclear do Hospital Universitário Clementino Fraga Filho da Universidade Federal do Rio de Janeiro. RESULTADOS: O campo de visão colimador-detector apresentou valores compatíveis com o tamanho da glândula para as distâncias de 25 cm (sonda de captação) e 45,8 cm (gama-câmara). Os fatores de calibração (cpm/kBq) foram 39,3 ± 0,78 e 4,3 ± 0,17, respectivamente. O intervalo entre 14 e 30 horas da curva de retenção permite o cálculo de atividade entre dois pontos, para determinação da meia-vida efetiva do iodo na tireóide. CONCLUSÃO: A utilização de equipamentos usualmente disponíveis em serviços de medicina nuclear é viável, tornando esta metodologia simples, eficaz e de baixo custo.

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extracts of the regional plants Annona squamosa and Annona muricata were analysed by silica gel thin-layer chromatography using adequate systems of solvents and spray reagents. Carbohydrates, amino acids, alkaloids, flavonoids and terpenoids were detected in both species. These data agree with those on the literature about phytochemistry of the Annonaceae.

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Recentlly, we have proposed the representation of lanthanides within AM1 as sparkles for the purpose of obtaing ground state geometries of their complexes. We tested our quantum chemical sparkle model (SMLC/AM1) for the prediction of the crystallographic structure of complexes with coordination number nine, eight and seven. A technique is introduced for the theoretical prediction of eletronic spectra of the organic part of lanthanide complexes by replacing the metal ion by a point charge with the ligands held in their positions as determined by the SMLC/AM1, and by computing the theoretical spectra via the intermediate neglect of differential overlap/spectroscopic-configuration interaction (INDO/S-CI).

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In this way it is very important to know the sulfate concentration in vinasse samples before to make the biodigestor design. A previous developed and indirect method (Anal. Chim. Acta. 1996, 329, 197), was used to determine sulfate in samples of vinasse, after previous treatments, done in order to eliminate organic matter with hydrogen peroxide 30% and concentrated nitric acid mixture (3:1), under heating. Interferent cationic ions were isolated by using ion exchange columns. The results obtained for some samples from Araraquara and Penápolis are here presented. The phosphate concentration was also determined.

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Statistical mechanics Monte Carlo simulation is reviewed as a formalism to study thermodynamic properties of liquids. Considering the importance of free energy changes in chemical processes, the thermodynamic perturbation theory implemented in the Monte Carlo method is discussed. The representation of molecular interaction by the Lennard-Jones and Coulomb potential functions is also discussed. Charges derived from quantum molecular electrostatic potential are also discussed as an useful methodology to generate an adequate set of partial charges to be used in liquid simulation.

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We analyse vibrational frequencies of 168 compounds with the AM1 model concerning its experimentally observed gaseous frequencies. Stretching of CH, NH, OH and CO bonds, its related bending frequencies, and the CC frame movements are the studied vibrations. The results show problems with the AM1 vibrational splittings. Often symmetric stretching frequencies, like in CH3, CH2 and NH3, appear switched with the corresponding antisymmetrical ones. Among the studied vibrations many stretchings are overestimated, while bendings oscillate around experimental values. Fluorine stretchings, NN, OO, CH, double and triples CC bonds and cyclic hydrocarbon breathing modes are always overestimated while torsions, umbrella modes and OH/SH stretching are, in average, underestimated. Graphical analysis show that compounds with the lowest molecular masses are the ones with the largest difference to the experimental values. From our results it is not possible to fit confortably the calculated frequencies by a simple linear relationship of the type, n(obs)=a*n(AM1). Better aggreement is obtained when different curves are adjusted for the stretching and bending modes, and when a complete linear function is used. Among our studies the best obtained statistical results are for CH, NH and OH. The conclusions obtained in this work will improve the AM1 calculated frequencies leading to accurate results for these properties.

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This paper describes in detail a technique employed to grow quasi-spherical single crystals of noble metals for electrochemical applications, using platinum as an example. The metal beads were formed by melting the extremity of a wire in an oxygen / butane flame. X-ray techniques were used to check the crystallization and to determine the orientation of the crystals. Treatment with a pure hydrogen flame followed by a cooling procedure in a hydrogen / argon atmosphere were used for conditioning the well-defined platinum single crystal surfaces. Finally, electrochemical characterization of the Pt(111), Pt(110) and Pt(100) surfaces was done in diluted sulfuric acid solution in the hydrogen adsorption / desorption potential region.

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In the last decade, many method has been developed to obtain oxysufides. However, theses materials were obtained by reaction involved gaseous toxics, CO, CS2, H2S and S. In the present work, the synthesis of lanthanum oxysufides actived by europium (III) through an alternative method has been made. This method involve the rare earth sulfate reduction under an atmosphere of argon contained 10% hydrogen using the thermogravimetric technique. The results showed the formation of the phase TR2O2S (TR = La and Eu) at temperatures which depend upon the heating rate, respectively 650 - 830ºC at 5ºC min-1 and 680 - 800ºC at 10ºC min-1. The oxysufides obtained are characterized by infrared spectroscopy. The method developed is more economic than the usual industrial methods and the environmental problems during the synthesis are also better controled.

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A methodology is presented to obtain force field parameters to be used in molecular mechanics. The case of Ru(II) is investigated and the parameters obtained, specially its covalent radii, are employed to model Ru(II) coordination compound. The combined use of molecular mechanics with ab initio methods allowed us to predict the metal-ligand stretching force constant for Ru(II) coordination compounds.

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In this work was developed an alternative methodology to separation of aquatic organic matter (AOM) present in natural river waters. The process is based in temperature decreasing of the aqueous sample under controlled conditions that provoke the freezing of the sample and separation of the dark extract, not frozen and rich in organic matter. The results showed that speed of temperature decreasing exerts strongly influence in relative recovery of organic carbon, enrichment and time separation of the organic matter present in water samples. Elemental composition, infrared spectra and thermal analysis results showed that the alternative methodology is less aggressive possible in the attempt of maintaining the integrity of the sample.

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Lapachol is a naphthoquinone found in several species of the Bignoniaceae family possessing mainly anticancer activity. The present work consists of the development and validation of analytical methodology for lapachol and its preparations. The results here obtained show that lapachol has a low quantification limit, that the analytical methodology is accurate, reproducible, robust and linear over the concentration range 0.5-100 µg/mL of lapachol.

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Four different pseudopotentials and three methodologies were employed in the calculation of the geometry and the frequencies of metal complexes like [M(NH3)2X2] [X=halogen, M=Zn, Cd], and [Hg(NH3)2]Cl2. The vibrational assignments were carefully checked and compared to the theoretically calculated ones. Graphical procedures were employed to estimate family errors and their average behavior. The calculated results show the SBK-X basis set with the best results for the geometries and calculated frequencies, for individual species and statistical results. Its use is recommend, mainly if the neighborhood atoms are described with similar pseudopotentials. Excellent results were also obtained with the Hay and Wadt pseudopotential.