715 research outputs found

    Novel strategies for process control based on hybrid semi-parametric mathematical systems

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    Tese de doutoramento. Engenharia QuĂ­mica. Universidade do Porto. Faculdade de Engenharia. 201

    Optimal experimental design and its applications to biochemical engineering systems

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    This work is motivated by challenges in data-based modelling of complex systems due to limited information of sparse and noisy experimental data. Optimal experimental design (OED) techniques, which aim at devising necessary experiments to generate informative measurement data to facilitate model identification, have been investigated comprehensively.The limitations of existing experimental design approaches have been extensively discussed, based on which advanced experimental design methods and efficient numerical strategies have been developed for improved solutions.;Two case study biochemical systems have been used through the research investigation, one is an enzyme reaction system, the other one is a lab-scale enzymatic biodiesel production system. The main contributions of this PhD work can be summarised as follows:;Single objective experimental designs by considering one type of design factors, i.e. input intensity, measurement set selection, sampling profile design, respectively, has been formulated and numerical strategies to solve these optimisation problems have been described in detail. Implementations of these design methods to biochemical systems have demonstrated its efficiency in reducing parameter estimation errors.;A new OED strategy has been proposed to cope with OED problems including multiple design factors in one optimisation framework. An iterative two-layer design structure is developed. In the lower layer for observation design, the sampling profile and the measurement set selection are combined and formulated as a single integrated observation design problem, which is relaxed to a convex optimization problem that can be solved with a local method.;Thus the measurement set selection and the sampling profile can be determined simultaneously. In the upper layer for input design, the optimisation of input intensities is obtained through stochastic global searching. In this way, the multi-factor optimisation problem is solved through the integration of a stochastic method, for the upper layer, and a deterministic method, for the lower layer.;A new enzyme reaction model has been established which represents a typical class of enzymatic kinetically controlled synthesis process. This model contains important kinetic reaction features, moderate complexity, and complete model information. It can be used as a benchmark problem for development and comparison of OED algorithms. Systematic analysis has been performed in order to examine the system behaviours, and the dependence on model parameters, initial operation conditions.;Structural identifiability and practical identifiability of this system have been analysed and identifiable parameters determined. The design of experiment for the enzyme reactionsystem by considering different types of design variables have been investigated. The parameter estimation precision can be improved significantly by using the proposed OED techniques, compared to the non-designed condition.;The OED techniques are numerically investigated based on a lab-scale biodiesel production process with real experimental data through research collaboration with DTU in Denmark. The OED applications on this real system model allow to examine the effectiveness and efficiency of those new proposed OED methods. The measurement set selection and the sampling design of this system are developed which provide detailed instructions on how to improve experiments through OED.;Also, the sensitivity analysis and parameter identifiability analysis are conducted; and their impacts to experimental design are clearly identified.This work is motivated by challenges in data-based modelling of complex systems due to limited information of sparse and noisy experimental data. Optimal experimental design (OED) techniques, which aim at devising necessary experiments to generate informative measurement data to facilitate model identification, have been investigated comprehensively.The limitations of existing experimental design approaches have been extensively discussed, based on which advanced experimental design methods and efficient numerical strategies have been developed for improved solutions.;Two case study biochemical systems have been used through the research investigation, one is an enzyme reaction system, the other one is a lab-scale enzymatic biodiesel production system. The main contributions of this PhD work can be summarised as follows:;Single objective experimental designs by considering one type of design factors, i.e. input intensity, measurement set selection, sampling profile design, respectively, has been formulated and numerical strategies to solve these optimisation problems have been described in detail. Implementations of these design methods to biochemical systems have demonstrated its efficiency in reducing parameter estimation errors.;A new OED strategy has been proposed to cope with OED problems including multiple design factors in one optimisation framework. An iterative two-layer design structure is developed. In the lower layer for observation design, the sampling profile and the measurement set selection are combined and formulated as a single integrated observation design problem, which is relaxed to a convex optimization problem that can be solved with a local method.;Thus the measurement set selection and the sampling profile can be determined simultaneously. In the upper layer for input design, the optimisation of input intensities is obtained through stochastic global searching. In this way, the multi-factor optimisation problem is solved through the integration of a stochastic method, for the upper layer, and a deterministic method, for the lower layer.;A new enzyme reaction model has been established which represents a typical class of enzymatic kinetically controlled synthesis process. This model contains important kinetic reaction features, moderate complexity, and complete model information. It can be used as a benchmark problem for development and comparison of OED algorithms. Systematic analysis has been performed in order to examine the system behaviours, and the dependence on model parameters, initial operation conditions.;Structural identifiability and practical identifiability of this system have been analysed and identifiable parameters determined. The design of experiment for the enzyme reactionsystem by considering different types of design variables have been investigated. The parameter estimation precision can be improved significantly by using the proposed OED techniques, compared to the non-designed condition.;The OED techniques are numerically investigated based on a lab-scale biodiesel production process with real experimental data through research collaboration with DTU in Denmark. The OED applications on this real system model allow to examine the effectiveness and efficiency of those new proposed OED methods. The measurement set selection and the sampling design of this system are developed which provide detailed instructions on how to improve experiments through OED.;Also, the sensitivity analysis and parameter identifiability analysis are conducted; and their impacts to experimental design are clearly identified

    On enforcing the necessary conditions of optimality under plant-model mismatch - What to measure and what to adapt?

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    Industrial processes are run with the aim of maximizing economic profit while simultaneously meeting process-critical constraints. To this end, model-based optimization can be performed to ensure optimal plant operations. Usually, inevitable model inaccuracies are dealt by collecting the plant measurements at the local operating conditions in order to adapt model parameters, followed by numerical re-optimization. This iterative two-step procedure often results in a sub-optimal solution, since the models are typically not designed for optimization. Modifier Adaptation (MA) is a Real-Time Optimization (RTO) technique that directly adds the affine-correction terms to the model. The affine corrections are parametrized in modifiers that are tailored to the optimization needs. This enables modifier adaptation to guarantee, upon convergence, matching the plant and the modified model's optimality conditions. However, computing the modifiers requires estimates of the plant gradients that are obtained via expensive plant experiments. The experimental cost can be reduced by relying more on the model of the considered plant. For example, Directional Modifier Adaptation (DMA) relies on offline-computed local parametric sensitivity analysis performed on the gradient of the Lagrangian function of the model resulting in reduced number of input directions that describe the gradient uncertainty in the model. Thereby, plant gradients are estimated only in a low-dimensional space of privileged input directions considerably reducing the experimental costs. However, local sensitivity analysis is often ineffective when the gradient of the model is considerably nonlinear in parameters. This thesis proposes an online procedure based on global sensitivity analysis for finding the most promising privileged directions that adequately compensates for the model deficiencies in predicting the plant optimality conditions. The discovered privileged directions are such that, upon parametric perturbations, the gradient varies a lot along the privileged directions and varies only a little along the remaining input directions. Consequently, the gradients of the model cost and constraints are corrected only along the privileged directions by adapting modifiers. The resulting methodology is named as Active Directional Modifier Adaptation (ADMA). Several simulation studies conducted show that the proposed approach reaches the near-optimality conditions at a considerably reduced experimental cost. In addition, this thesis attempts to establish a direct relation between the optimality conditions and the parameters of a given model. Model parameters are analyzed to discover mirror parameters that mimic the behavior of modifiers in influencing the optimality conditions. It is proposed to adapt mirror parameters instead of modifiers yielding the benefit of both, modifier adaptation in enforcing optimality conditions and of parameter adaptation in better noise handling and convergence. Moreover, it is investigated how to establish the synergies between privileged input directions with model parameters in order to reduce experimental efforts. The steady-state optimization of a simulated chemical process shows that the privileged directions and the selected parameters work together to reach near-optimal performance. Finally, the study on the power maximization of flying kites leads to the development of trust-region based ADMA method to better control the input step size
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