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Multi-criteria optimization has gained increasing attention during the last decades. This article exemplifies multi-criteria features, which are implemented in the statistical software package SPOT. It describes related software packages such as mco and emoa and gives a comprehensive introduction to simple multi criteria optimization tasks. Several hands-on examples are used for illustration. The article is well-suited as a starting point for performing multi-criteria optimization tasks with SPOT.
There is a strong need for sound statistical analysis of simulation and optimization algorithms. Based on this analysis, improved parameter settings can be determined. This will be referred to as tuning. Model-based investigations are common approaches in simulation and optimization. The sequential parameter optimization toolbox (SPOT), which is implemented as a package for the statistical programming language R, provides sophisticated means for tuning and understanding simulation and optimization algorithms. The toolbox includes methods for tuning based on classical regression and analysis of variance techniques; tree-based models such as classification and regressions trees (CART) and random forest; Gaussian process models (Kriging), and combinations of different meta-modeling approaches. This article exemplifies how an existing optimization algorithm, namely simulated annealing, can be tuned using the SPOT framework.
Dieser Schlussbericht beschreibt die im Projekt „CI-basierte mehrkriterielle Optimierungsverfahren für Anwendungen in der Industrie“ (CIMO) im Zeitraum von November 2011 bis einschließlich Oktober 2014 erzielten Ergebnisse. Für aufwändige Optimierungsprobleme aus der Industrie wurden geeignete Lösungsverfahren entwickelt. Der Schwerpunkt lag hierbei auf Methoden aus den Bereichen Computational Intelligence (CI) und Surrogatmodellierung. Diese bieten die Möglichkeit, wichtige Herausforderung von aufwändigen, komplexen Optimierungsproblemen zu lösen. Die entwickelten Methoden können verschiedene konfliktäre Zielgrößen berücksichtigen, verschiedene Hierarchieebenen des Problems in die Optimierung integrieren, Nebenbedingungen beachten, vektorielle aber auch strukturierte Daten verarbeiten (kombinatorische Optimierung) sowie die Notwendigkeit teurer/zeitaufwändiger Zielfunktionsberechnungen reduzieren. Die entwickelten Methoden wurden schwerpunktmäßig auf einer Problemstellung aus der Kraftwerkstechnik angewendet, nämlich der Optimierung der Geometrie eines Fliehkraftabscheiders (auch: Zyklon), der Staubanteile aus Abgasen filtert. Das Optimierungsproblem, das diese FIiehkraftabscheider aufwerfen, führt zu konfliktären Zielsetzungen (z.B. Druckverlust, Abscheidegrad). Zyklone können unter anderem über aufwändige Computational Fluid Dynamics (CFD) Simulationen berechnet werden, es stehen aber auch einfache analytische Gleichungen als Schätzung zu Verfügung. Die Verknüpfung von beidem zeigt hier beispielhaft wie Hierarchieebenen eines Optimierungsproblems mit den Methoden des Projektes verbunden werden können. Neben dieser Schwerpunktanwendung konnte auch gezeigt werden, dass die Methoden in vielen weiteren Bereichen Erfolgreich zur Anwendung kommen können: Biogaserzeugung, Wasserwirtschaft, Stahlindustrie. Die besondere Herausforderung der behandelten Probleme und Methoden bietet viele wichtige Forschungsmöglichkeiten für zukünftige Projekte, die derzeit durch die Projektpartner vorbereitet werden.
The availability of several CPU cores on current computers enables
parallelization and increases the computational power significantly.
Optimization algorithms have to be adapted to exploit these highly
parallelized systems and evaluate multiple candidate solutions in
each iteration. This issue is especially challenging for expensive
optimization problems, where surrogate models are employed to
reduce the load of objective function evaluations.
This paper compares different approaches for surrogate modelbased
optimization in parallel environments. Additionally, an easy
to use method, which was developed for an industrial project, is
proposed. All described algorithms are tested with a variety of
standard benchmark functions. Furthermore, they are applied to
a real-world engineering problem, the electrostatic precipitator
problem. Expensive computational fluid dynamics simulations are
required to estimate the performance of the precipitator. The task
is to optimize a gas-distribution system so that a desired velocity
distribution is achieved for the gas flow throughout the precipitator.
The vast amount of possible configurations leads to a complex
discrete valued optimization problem. The experiments indicate
that a hybrid approach works best, which proposes candidate solutions
based on different surrogate model-based infill criteria and
evolutionary operators.
Benchmark experiments are required to test, compare, tune, and understand optimization algorithms. Ideally, benchmark problems closely reflect real-world problem behavior. Yet, real-world problems are not always readily available for benchmarking. For example, evaluation costs may be too high, or resources are unavailable (e.g., software or equipment). As a solution, data from previous evaluations can be used to train surrogate models which are then used for benchmarking. The goal is to generate test functions on which the performance of an algorithm is similar to that on the real-world objective function. However, predictions from data-driven models tend to be smoother than the ground-truth from which the training data is derived. This is especially problematic when the training data becomes sparse. The resulting benchmarks may not reflect the landscape features of the ground-truth, are too easy, and may lead to biased conclusions.
To resolve this, we use simulation of Gaussian processes instead of estimation (or prediction). This retains the covariance properties estimated during model training. While previous research suggested a decomposition-based approach for a small-scale, discrete problem, we show that the spectral simulation method enables simulation for continuous optimization problems. In a set of experiments with an artificial ground-truth, we demonstrate that this yields more accurate benchmarks than simply predicting with the Gaussian process model.
Data pre-processing is a key research topic in data mining because it plays a
crucial role in improving the accuracy of any data mining algorithm. In most
real world cases, a significant amount of the recorded data is found missing
due to most diverse errors. This loss of data is nearly always unavoidable.
Recovery of missing data plays a vital role in avoiding inaccurate data
mining decisions. Most multivariate imputation methods are not compatible
to univariate datasets and the traditional univariate imputation techniques
become highly biased as the missing data gap increases. With the current
technological advancements abundant data is being captured every second.
Hence, we intend to develop a new algorithm that enables maximum
utilization of the available big datasets for imputation. In this paper, we
present a Seasonal and Trend decomposition using Loess (STL) based
Seasonal Moving Window Algorithm, which is capable of handling patterns
with trend as well as cyclic characteristics. We show that the algorithm is
highly suitable for pre-processing of large datasets.
Surrogate-based optimization relies on so-called infill criteria (acquisition functions) to decide which point to evaluate next. When Kriging is used as the surrogate model of choice (also called Bayesian optimization), one of the most frequently chosen criteria is expected improvement. We argue that the popularity of expected improvement largely relies on its theoretical properties rather than empirically validated performance. Few results from the literature show evidence, that under certain conditions, expected improvement may perform worse than something as simple as the predicted value of the surrogate model. We benchmark both infill criteria in an extensive empirical study on the ‘BBOB’ function set. This investigation includes a detailed study of the impact of problem dimensionality on algorithm performance. The results support the hypothesis that exploration loses importance with increasing problem dimensionality. A statistical analysis reveals that the purely exploitative search with the predicted value criterion performs better on most problems of five or higher dimensions. Possible reasons for these results are discussed. In addition, we give an in-depth guide for choosing the infill criteria based on prior knowledge about the problem at hand, its dimensionality, and the available budget.
When researchers and practitioners in the field of
computational intelligence are confronted with real-world
problems, the question arises which method is the best to
apply. Nowadays, there are several, well established test
suites and well known artificial benchmark functions
available.
However, relevance and applicability of these methods to
real-world problems remains an open question in many
situations. Furthermore, the generalizability of these
methods cannot be taken for granted.
This paper describes a data-driven approach for the
generation of test instances, which is based on
real-world data. The test instance generation uses
data-preprocessing, feature extraction, modeling, and
parameterization. We apply this methodology on a classical
design of experiment real-world project and generate test
instances for benchmarking, e.g. design methods, surrogate
techniques, and optimization algorithms. While most
available results of methods applied on real-world
problems lack availability of the data for comparison,
our future goal is to create a toolbox covering multiple
data sets of real-world projects to provide a test
function generator to the research community.
The performance of optimization algorithms relies crucially on their parameterizations. Finding good parameter settings is called algorithm tuning. Using
a simple simulated annealing algorithm, we will demonstrate how optimization algorithms can be tuned using the Sequential Parameter Optimization Toolbox (SPOT). SPOT provides several tools for automated and interactive tuning. The underlying concepts of the SPOT approach are explained. This includes key techniques such as exploratory fitness landscape analysis and response surface methodology. Many examples illustrate
how SPOT can be used for understanding the performance of algorithms and gaining insight into algorithm behavior. Furthermore, we demonstrate how SPOT can be used as an optimizer and how a sophisticated ensemble approach is able to combine several meta models via stacking.
We propose to apply typed Genetic Programming (GP) to the problem of finding surrogate-model ensembles for global optimization on compute-intensive target functions. In a model ensemble, base-models such as linear models, random forest models, or Kriging models, as well as pre- and post-processing methods, are combined. In theory, an optimal ensemble will join the strengths of its comprising base-models while avoiding their weaknesses, offering higher prediction accuracy and robustness. This study defines a grammar of model ensemble expressions and searches the set for optimal ensembles via GP. We performed an extensive experimental study based on 10 different objective functions and 2 sets of base-models. We arrive at promising results, as on unseen test data, our ensembles perform not significantly worse than the best base-model.