Prognóstico do consumo de energia elétrica nos sistemas urbanos de abastecimento de água em pequenos e médios municípios da região paulista do vale do rio Paraíba do Sul

Coordenação de Aperfeiçoamento de Pessoal de Nível Superior (CAPES)

Eficiência de estimadores, geradores e algoritmos na simulação de dados diários de precipitação pluviométrica utilizando a distribuição gama

Pós-graduação em Agronomia (Energia na Agricultura) - FCA

Analisando a determinação sexual de vertebrados com base em redes de interação entre proteínas

Pós-graduação em Ciências Biológicas (Genética) - IBB

Desenvolvimento de um algoritmo computacional MoM 3D aplicado em nanoplasmônica

Este trabalho apresenta o desenvolvimento de um algoritmo computacional para análise do espalhamento eletromagnético de nanoestruturas plasmônicas isoladas. O Método dos Momentos tridimensional (MoM-3D) foi utilizado para resolver numericamente a equação integral do campo elétrico, e o modelo de Lorentz-Drude foi usado para representar a permissividade complexa das nanoestruturas metálicas. Baseado nesta modelagem matemática, um algoritmo computacional escrito em linguagem C foi desenvolvido. Como exemplo de aplicação e validação do código, dois problemas clássicos de espalhamento eletromagnético de nanopartículas metálicas foram analisados: nanoesfera e nanobarra, onde foram calculadas a resposta espectral e a distribuição do campo próximo. Os resultados obtidos foram comparados com resultados calculados por outros modelos e observou-se uma boa concordância e convergência entre eles.

Desenvolvimento de algoritmo para modelagem e simulação de sistemas por grafos de ligação

Coordenação de Aperfeiçoamento de Pessoal de Nível Superior (CAPES)

Quantification of Biological Tissue and Construction of Patient Equivalent Phantom (Skull and Chest) for Infants (1-5 years old)

Our main purpose in this study was to quantify biological tissue in computed tomography (CT) examinations with the aim of developing a skull and a chest patient equivalent phantom (PEP), both specific to infants, aged between 1 and 5 years old. This type of phantom is widely used in the development of optimization procedures for radiographic techniques, especially in computed radiography (CR) systems. In order to classify and quantify the biological tissue, we used a computational algorithm developed in Matlab (R). The algorithm performed a histogram of each CT slice followed by a Gaussian fitting of each tissue type. The algorithm determined the mean thickness for the biological tissues (bone, soft, fat, and lung) and also converted them into the corresponding thicknesses of the simulator material (aluminum, PMMA, and air). We retrospectively analyzed 148 CT examinations of infant patients, 56 for skull exams and 92 were for chest. The results provided sufficient data to construct a phantom to simulate the infant chest and skull in the posterior anterior or anterior posterior (PA/AP) view. Both patient equivalent phantoms developed in this study can be used to assess physical variables such as noise power spectrum (NPS) and signal to noise ratio (SNR) or perform dosimetric control specific to pediatric protocols.

Simulação numérica de fluxo de águas subterrâneas na bacia do Rio Grande (BA)

The Urucuia Aquifer System represents a strategic water source in western Bahia. Its baseflow is responsible for the flow rate of the main tributaries of São Francisco river left bank in the dry season, including the Rio Grande, its main tributary in Bahia state. This river has a hydrological regime heavily affected by groundwater and is located in a region with conflicts about water resources. The aquifers geology is constituted by neocretacious sandstones of Urucuia Group subdivided in Posse Formation and Serra das Araras Formation. The embasement is formed by neoproterozoic rocks of Bambuí Group. This work focuses on an important tool application, the mathematical model, whose function is represent approximately and suitably the reality so that can assist in different scenarios simulations and make predictions. Many studies developed in this basin provided the conceptual model basis including a full free aquifer, lithological and hydraulical homogeneity in entire basin, null flux at plateau borders and aquifer base. The finite element method is the numerical method used and FEFLOW the computational algorithm. The simulated area was discretized in a single layer with 27.357,6 km² (314.432 elements and 320.452 nodes) totaling a 4.249,89 km³ volume. Were utilized 21 observation wells from CERB to calibrate the model. The terrain topography was obtained by SRTM data and the impermeable base was generated by interpolation of descriptive profiles from wells and electric vertical drilling from previous studies. Works in this area obtained mean recharge rates varying approximately from 20% to 25% of average precipitation, thus the values of model recharge zones varying in this range. Were distributed 4 hydraulic conductivity zones: (K1) west zone with K=6x10-5 m/s; (K2) center-east zone with K=3x10-4 m/s; (K3) far east zone with K=5x10-4 m/s; e (K4) east-north zone with K=1x10-5 m/s. Thereby was incorporated to the final conceptual model...

Construção de fantomas homogêneos pediátricos de crãnio e tórax para otimização de imagens em radiografia computadorizada

Coordenação de Aperfeiçoamento de Pessoal de Nível Superior (CAPES)

Construction of pediatric homogeneous phantoms for optimization of chest and skull radiographs

Coordenação de Aperfeiçoamento de Pessoal de Nível Superior (CAPES)

Simulação numérica de fluxo de águas subterrâneas do aquífero Rio Claro, na região do campus da UNESP - Rio Claro, SP

The water management in any area is highly important to the success of many business and also of life and the understanding of your relationship with the environment brings better control to its demand. I.e. hydrogeological studies are needed under better understanding of the behavior of an aquifer, so that its management is done so as not to deplete or harm it. The objective of this work is the numerical modeling in transient regime of a portion of the Rio Claro aquifer formation in order to get answers about its hydrogeological parameters, its main flow direction and also its most sensitive parameters. A literature review and conceptual characterization of the aquifer, combined with field campaigns and monitoring of local water level (NA), enabled the subsequent construction of the mathematical model by finite elements method, using the FEFLOW 6.1 ® computational algorithm. The study site includes the campus of UNESP and residential and industrial areas of Rio Claro city. Its area of 9.73 km ² was divided into 318040 triangular elements spread over six layers, totaling a volume of 0.25 km³. The local topography and geological contacts were obtained from previous geological and geophysical studies as well as profiles of campus wells and SIAGAS / CPRM system. The seven monitoring wells on campus were set up as observation points for calibration and checking of the simulation results. Sampling and characterization of Rio Claro sandstones shows up a high hydrological and lithological heterogeneity for the aquifer formation. The simulation results indicate values of hydraulic conductivity between 10-6 and 10-4 m / s, getting the Recharge/Rainfall simulation in transient ratio at 13%. Even with the simplifications imposed on the model, it was able to represent the fluctuations of local NA over a year of monitoring. The result was the exit of 3774770 m³ of water and the consequently NA fall. The model is considered representative for the...

Indicatori di correlazione e di disordine basati sul concetto di entropia

The aim of this work is to carry out an applicative, comparative and exhaustive study between several entropy based indicators of independence and correlation. We considered some indicators characterized by a wide and consolidate literature, like mutual information, joint entropy, relative entropy or Kullback Leibler distance, and others, more recently introduced, like Granger, Maasoumi and racine entropy, also called Sρ, or utilized in more restricted domains, like Pincus approximate entropy or ApEn. We studied the behaviour of such indicators applying them to binary series. The series was designed to simulate a wide range of situations in order to characterize indicators limit and capability and to identify, case by case, the more useful and trustworthy ones. Our target was not only to study if such indicators were able to discriminate between dependence and independence because, especially for mutual information and Granger, Maasoumi and Racine, that was already demonstrated and reported in literature, but also to verify if and how they were able to provide information about structure, complexity and disorder of the series they were applied to. Special attention was paid on Pincus approximate entropy, that is said by the author to be able to provide information regarding the level of randomness, regularity and complexity of a series. By means of a focused and extensive research, we furthermore tried to clear the meaning of ApEn applied to a couple of different series. In such situation the indicator is named in literature as cross-ApEn. The cross-ApEn meaning and the interpretation of its results is often not simple nor univocal and the matter is scarcely delved into by literature, thereby users can easily leaded up to a misleading conclusion, especially if the indicator is employed, as often unfortunately it happens, in uncritical manner. In order to plug some cross-ApEn gaps and limits clearly brought out during the experimentation, we developed and applied to the already considered cases a further indicator we called “correspondence index”. The correspondence index is perfectly integrated into the cross-ApEn computational algorithm and it is able to provide, at least for binary data, accurate information about the intensity and the direction of an eventual correlation, even not linear, existing between two different series allowing, in the meanwhile, to detect an eventual condition of independence between the series themselves.

Existence and Uniqueness of Equilibrium in Nonoptimal Unbounded Infinite Horizon Economies

In applied work in macroeconomics and finance, nonoptimal infinite horizon economies are often studied in the the state space is unbounded. Important examples of such economies are single vector growth models with production externalities, valued fiat money, monopolistic competition, and/or distortionary government taxation. Although sufficient conditions for existence and uniqueness of Markovian equilibrium are well known for the compact state space case, no similar sufficient conditions exist for unbounded growth. This paper provides such a set of sufficient conditions, and also present a computational algorithm that will prove asymptotically consistent when computing Markovian equilibrium.

Construction of an Intraplate Fault System Model of South Australia, and Simulation Tool for the iSERVO Institute Seed Project

To foster ongoing international cooperation beyond ACES (APEC Cooperation for Earthquake Simulation) on the simulation of solid earth phenomena, agreement was reached to work towards establishment of a frontier international research institute for simulating the solid earth: iSERVO = International Solid Earth Research Virtual Observatory institute (http://www.iservo.edu.au). This paper outlines a key Australian contribution towards the iSERVO institute seed project, this is the construction of: (1) a typical intraplate fault system model using practical fault system data of South Australia (i.e., SA interacting fault model), which includes data management and editing, geometrical modeling and mesh generation; and (2) a finite-element based software tool, which is built on our long-term and ongoing effort to develop the R-minimum strategy based finite-element computational algorithm and software tool for modelling three-dimensional nonlinear frictional contact behavior between multiple deformable bodies with the arbitrarily-shaped contact element strategy. A numerical simulation of the SA fault system is carried out using this software tool to demonstrate its capability and our efforts towards seeding the iSERVO Institute.

Développement et applications d’un outil bio-informatique pour la détection de similarités de champs d’interaction moléculaire

Résumé : Les méthodes de détection de similarités de sites de liaison servent entre autres à la prédiction de fonction et à la prédiction de cibles croisées. Ces méthodes peuvent aider à prévenir les effets secondaires, suggérer le repositionnement de médicament existants, identifier des cibles polypharmacologiques et des remplacements bio-isostériques. La plupart des méthodes utilisent des représentations basées sur les atomes, même si les champs d’interaction moléculaire (MIFs) représentent plus directement ce qui cherche à être identifié. Nous avons développé une méthode bio-informatique, IsoMif, qui détecte les similarités de MIF entre différents sites de liaisons et qui ne nécessite aucun alignement de séquence ou de structure. Sa performance a été comparée à d’autres méthodes avec des bancs d’essais, ce qui n’a jamais été fait pour une méthode basée sur les MIFs. IsoMif performe mieux en moyenne et est plus robuste. Nous avons noté des limites intrinsèques à la méthodologie et d’autres qui proviennent de la nature. L’impact de choix de conception sur la performance est discuté. Nous avons développé une interface en ligne qui permet la détection de similarités entre une protéine et différents ensembles de MIFs précalculés ou à des MIFs choisis par l’utilisateur. Des sessions PyMOL peuvent être téléchargées afin de visualiser les similarités identifiées pour différentes interactions intermoléculaires. Nous avons appliqué IsoMif pour identifier des cibles croisées potentielles de drogues lors d’une analyse à large échelle (5,6 millions de comparaisons). Des simulations d’arrimage moléculaire ont également été effectuées pour les prédictions significatives. L’objectif est de générer des hypothèses de repositionnement et de mécanismes d’effets secondaires observés. Plusieurs exemples sont présentés à cet égard.

Análise e modelagem do escoamento transitório de fluidos de perfuração

Drilling fluids present a thixotropic behavior and they usually gel when at rest. The sol-gel transition is fundamental to prevent the deposit of rock fragments, generated by drilling the well, over the drill bit during eventual stops. Under those conditions, high pressures are then required in order to break-up the gel when circulation is resumed. Moreover, very high pressures can damage the rock formation at the bottom of the well. Thus, a better understanding of thixotropy and the behavior of thixotropic materials becomes increasingly important for process control. The mechanisms that control thixotropy are not yet well defined and modeling is still a challenge. The objective of this work is to develop a mathematical model to study the pressure transmission in drilling fluids. This work presents a review of thixotropy and of different mathematical models found in the literature that are used to predict such characteristic. It also shows a review of transient flows of compressible fluids. The problem is modeled as the flow between the drillpipe and the annular region (space between the wall and the external part of the drillpipe). The equations that describe the problem (mass conservation, momentum balance, constitutive and state) are then discretized and numerically solved by using a computational algorithm in Fortran. The model is validated with experimental and numerical data obtained from the literature. Comparisons between experimental data obtained from Petrobras and calculated by three viscoplastic and one pseudoplastic models are conducted. The viscoplastic fluids, due to the yield stress, do not fully transmit the pressure to the outlet of the annular space. Sensibility analyses are then conducted in order to evaluate the thixotropic effect in pressure transmission.