Computational steering of a multi-objective genetic algorithm using a PDA

The execution process of a genetic algorithm typically involves some trial-and-error. This is due to the difficulty in setting the initial parameters of the algorithm – especially when little is known about the problem domain. The problem is magnified when applied to multi-objective optimisation, as care is needed to ensure that the final population of candidate solutions is representative of the trade-off surface. We propose a computational steering system that allows the engineer to interact with the optimisation routine during execution. This interaction can be as simple as monitoring the values of some parameters during the execution process, or could involve altering those parameters to influence the quality of the solutions produce by the optimisation process

A Multi-objective Genetic Algorithm for Peptide Optimization

The peptide-based drug design process requires the identification of a wide range of candidate molecules with specific biological, chemical and physical properties. The laboratory analysis in terms of in vitro methods for the discovery of several physiochemical properties of theoretical candidate molecules is time- and cost-intensive. Hence, in silico methods are required for this purpose. Metaheuristics like evolutionary algorithms are considered to be adequate in silico methods providing good approximate solutions to the underlying multiobjective optimization problems. The general issue in this area is the design of a multi-objective evolutionary algorithm to achieve a maximum number of high-quality candidate peptides that differ in their genetic material, in a minimum number of generations. A multi-objective evolutionary algorithm as an in silico method of discovering a large number of high-quality peptides within a low number of generations for a broad class of molecular optimization problems of different dimensions is challenging, and the development of such a promising multi-objective evolutionary algorithm based on theoretical considerations is the major contribution of this thesis. The design of this algorithm is based on a qualitative landscape analysis applied on a three- and four-dimensional biochemical optimization problem. The conclusions drawn from the empirical landscape analysis of the three- and four-dimensional optimization problem result in the formulation of hypotheses regarding the types of evolutionary algorithm components which lead to an optimized search performance for the purpose of peptide optimization. Starting from the established types of variation operators and selection strategies, different variation operators and selection strategies are proposed and empirically verified on the three- and four-dimensional molecular optimization problem with regard to an optimized interaction and the identification of potential interdependences as well as a fine-tuning of the parameters. Moreover, traditional issues in the field of evolutionary algorithms such as selection pressure and the influence of multi-parent recombination are investigated

A lexicographic multi-objective genetic algorithm for multi-label correlation-based feature selection

This paper proposes a new Lexicographic multi-objective Genetic Algorithm for Multi-Label Correlation-based Feature Selection (LexGA-ML-CFS), which is an extension of the previous single-objective Genetic Algorithm for Multi-label Correlation-based Feature Selection (GA-ML-CFS). This extension uses a LexGA as a global search method for generating candidate feature subsets. In our experiments, we compare the results obtained by LexGA-ML-CFS with the results obtained by the original hill climbing-based ML-CFS, the single-objective GA-ML-CFS and a baseline Binary Relevance method, using ML-kNN as the multi-label classifier. The results from our experiments show that LexGA-ML-CFS improved predictive accuracy, by comparison with other methods, in some cases, but in general there was no statistically significant different between the results of LexGA-ML-CFS and other methods

Navigation Constellation Design Using a Multi-Objective Genetic Algorithm

In satellite constellation design, performance and cost of the system drive the design process. The Global Positioning System (GPS) constellation is currently used to provide positioning and timing worldwide. As satellite technology has improved over the years, the cost to develop and maintain the satellites has increased. Using a constellation design tool, it is possible to analyze the tradeoffs of new navigation constellation designs (Pareto fronts) that illustrate the tradeoffs between position dilution of precision (PDOP) and system cost. This thesis utilized Satellite Tool Kit (STK) to calculate PDOP values of navigation constellations, and the Unmanned Spacecraft Cost Model (USCM) along with the Small Spacecraft Cost Model (SSCM) to determine system cost. The design parameters used include Walker constellation parameters, orbital elements, and transmit power. The results show that the constellation design tool produces realistic solutions. Using the generated solutions, an analysis of the navigation constellation designs was presented

Multi-Objective Genetic Algorithm for Pseudoknotted RNA Sequence Design

RNA inverse folding is a computational technology for designing RNA sequences which fold into a user-specified secondary structure. Although pseudoknots are functionally important motifs in RNA structures, less reports concerning the inverse folding of pseudoknotted RNAs have been done compared to those for pseudoknot-free RNA design. In this paper, we present a new version of our multi-objective genetic algorithm (MOGA), MODENA, which we have previously proposed for pseudoknot-free RNA inverse folding. In the new version of MODENA, (i) a new crossover operator is implemented and (ii) pseudoknot prediction methods, IPknot and HotKnots, are used to evaluate the designed RNA sequences, allowing us to perform the inverse folding of pseudoknotted RNAs. The new version of MODENA with the new crossover operator was benchmarked with a dataset composed of natural pseudoknotted RNA secondary structures, and we found that MODENA can successfully design more pseudoknotted RNAs compared to the other pseudoknot design algorithm. In addition, a sequence constraint function newly implemented in the new version of MODENA was tested by designing RNA sequences which fold into the pseudoknotted structure of a hepatitis delta virus ribozyme; as a result, we successfully designed eight RNA sequences. The new version of MODENA is downloadable from http://rna.eit.hirosaki-u.ac.jp/modena/