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Gabriela Ochoa

Publications and source records attributed to Gabriela Ochoa.

At least 19 recordsLinked to original sources

Semantic Space Search Trajectory Networks

Search Trajectory Networks (STNs) are a graph-based tool for visualizing and characterizing the behavior of optimization algorithms. STNs' reliance on discretization of the search space has largely confined them to low-dimensional or combinatorial settings. We introduce a methodology for constructing STNs in semantic spaces, defined as the space of a model's predictions on a fixed sample set. Our approach discretizes semantic vectors and aggregates them into network nodes via agglomerative clustering with complete linkage under a normalized Hamming distance. Since any predictor can be summarized by its semantic vector, this method enables comparison of learning dynamics across otherwise incomparable algorithm families. We apply semantic space STNs to classification and regression tasks solved using different machine learning algorithms, recovering known qualitative differences between them. Additionally, we use semantic space STNs to study neural network generalization by contrasting standard training with the label randomization regime of Zhang et al. (2017). The resulting STNs exhibit consistent structural differences, training on real labels produces denser, more efficient and more centralized graphs than training on shuffled labels. Together, our results show that semantic space STNs capture functional training dynamics arising from the interaction between learning algorithms and data, providing a tool for analyzing and comparing learning dynamics across machine learning models and training regimes.

cs.LG

Behaviour Space Analysis of LLM-driven Meta-heuristic Discovery

We investigate the behaviour space of meta-heuristic optimisation algorithms automatically generated by Large Language Model driven algorithm discovery methods. Using the Large Language Evolutionary Algorithm (LLaMEA) framework with a GPT o4-mini LLM, we iteratively evolve black-box optimisation heuristics, evaluated on 10 functions from the BBOB benchmark suite. Six LLaMEA variants, featuring different mutation prompt strategies, are compared and analysed. We log dynamic behavioural metrics including exploration, exploitation, convergence and stagnation measures, for each run, and analyse these via visual projections and network-based representations. Our analysis combines behaviour-based projections, Code Evolution Graphs built from static code features, performance convergence curves, and behaviour-based Search Trajectory Networks. The results reveal clear differences in search dynamics and algorithm structures across LLaMEA configurations. Notably, the variant that employs both a code simplification prompt and a random perturbation prompt in a 1+1 elitist evolution strategy, achieved the best performance, with the highest Area Over the Convergence Curve. Behaviour-space visualisations show that higher-performing algorithms exhibit more intensive exploitation behaviour and faster convergence with less stagnation. Our findings demonstrate how behaviour-space analysis can explain why certain LLM-designed heuristics outperform others and how LLM-driven algorithm discovery navigates the open-ended and complex search space of algorithms. These findings provide insights to guide the future design of adaptive LLM-driven algorithm generators.

cs.NE

Customized Exploration of Landscape Features Driving Multi-Objective Combinatorial Optimization Performance

We present an analysis of landscape features for predicting the performance of multi-objective combinatorial optimization algorithms. We consider features from the recently proposed compressed Pareto Local Optimal Solutions Networks (C-PLOS-net) model of combinatorial landscapes. The benchmark instances are a set of rmnk-landscapes with 2 and 3 objectives and various levels of ruggedness and objective correlation. We consider the performance of three algorithms -- Pareto Local Search (PLS), Global Simple EMO Optimizer (GSEMO), and Non-dominated Sorting Genetic Algorithm (NSGA-II) - using the resolution and hypervolume metrics. Our tailored analysis reveals feature combinations that influence algorithm performance specific to certain landscapes. This study provides deeper insights into feature importance, tailored to specific rmnk-landscapes and algorithms.

cs.NE

Generalizing and Unifying Gray-box Combinatorial Optimization Operators

Gray-box optimization leverages the information available about the mathematical structure of an optimization problem to design efficient search operators. Efficient hill climbers and crossover operators have been proposed in the domain of pseudo-Boolean optimization and also in some permutation problems. However, there is no general rule on how to design these efficient operators in different representation domains. This paper proposes a general framework that encompasses all known gray-box operators for combinatorial optimization problems. The framework is general enough to shed light on the design of new efficient operators for new problems and representation domains. We also unify the proofs of efficiency for gray-box hill climbers and crossovers and show that the mathematical property explaining the speed-up of gray-box crossover operators, also explains the efficient identification of improving moves in gray-box hill climbers. We illustrate the power of the new framework by proposing an efficient hill climber and crossover for two related permutation problems: the Linear Ordering Problem and the Single Machine Total Weighted Tardiness Problem.

cs.NE

Large Language Models for the Automated Analysis of Optimization Algorithms

The ability of Large Language Models (LLMs) to generate high-quality text and code has fuelled their rise in popularity. In this paper, we aim to demonstrate the potential of LLMs within the realm of optimization algorithms by integrating them into STNWeb. This is a web-based tool for the generation of Search Trajectory Networks (STNs), which are visualizations of optimization algorithm behavior. Although visualizations produced by STNWeb can be very informative for algorithm designers, they often require a certain level of prior knowledge to be interpreted. In an attempt to bridge this knowledge gap, we have incorporated LLMs, specifically GPT-4, into STNWeb to produce extensive written reports, complemented by automatically generated plots, thereby enhancing the user experience and reducing the barriers to the adoption of this tool by the research community. Moreover, our approach can be expanded to other tools from the optimization community, showcasing the versatility and potential of LLMs in this field.

cs.AI

Dynastic Potential Crossover Operator

An optimal recombination operator for two parent solutions provides the best solution among those that take the value for each variable from one of the parents (gene transmission property). If the solutions are bit strings, the offspring of an optimal recombination operator is optimal in the smallest hyperplane containing the two parent solutions. Exploring this hyperplane is computationally costly, in general, requiring exponential time in the worst case. However, when the variable interaction graph of the objective function is sparse, exploration can be done in polynomial time. In this paper, we present a recombination operator, called Dynastic Potential Crossover (DPX), that runs in polynomial time and behaves like an optimal recombination operator for low-epistasis combinatorial problems. We compare this operator, both theoretically and experimentally, with traditional crossover operators, like uniform crossover and network crossover, and with two recently defined efficient recombination operators: partition crossover and articulation points partition crossover. The empirical comparison uses NKQ Landscapes and MAX-SAT instances. DPX outperforms the other crossover operators in terms of quality of the offspring and provides better results included in a trajectory and a population-based metaheuristic, but it requires more time and memory to compute the offspring.

cs.NE

Multiobjective Evolutionary Component Effect on Algorithm behavior

The performance of multiobjective evolutionary algorithms (MOEAs) varies across problems, making it hard to develop new algorithms or apply existing ones to new problems. To simplify the development and application of new multiobjective algorithms, there has been an increasing interest in their automatic design from their components. These automatically designed metaheuristics can outperform their human-developed counterparts. However, it is still unknown what are the most influential components that lead to performance improvements. This study specifies a new methodology to investigate the effects of the final configuration of an automatically designed algorithm. We apply this methodology to a tuned Multiobjective Evolutionary Algorithm based on Decomposition (MOEA/D) designed by the iterated racing (irace) configuration package on constrained problems of 3 groups: (1) analytical real-world problems, (2) analytical artificial problems and (3) simulated real-world. We then compare the impact of the algorithm components in terms of their Search Trajectory Networks (STNs), the diversity of the population, and the anytime hypervolume values. Looking at the objective space behavior, the MOEAs studied converged before half of the search to generally good HV values in the analytical artificial problems and the analytical real-world problems. For the simulated problems, the HV values are still improving at the end of the run. In terms of decision space behavior, we see a diverse set of the trajectories of the STNs in the analytical artificial problems. These trajectories are more similar and frequently reach optimal solutions in the other problems.

cs.NE

Phenotype Search Trajectory Networks for Linear Genetic Programming

Genotype-to-phenotype mappings translate genotypic variations such as mutations into phenotypic changes. Neutrality is the observation that some mutations do not lead to phenotypic changes. Studying the search trajectories in genotypic and phenotypic spaces, especially through neutral mutations, helps us to better understand the progression of evolution and its algorithmic behaviour. In this study, we visualise the search trajectories of a genetic programming system as graph-based models, where nodes are genotypes/phenotypes and edges represent their mutational transitions. We also quantitatively measure the characteristics of phenotypes including their genotypic abundance (the requirement for neutrality) and Kolmogorov complexity. We connect these quantified metrics with search trajectory visualisations, and find that more complex phenotypes are under-represented by fewer genotypes and are harder for evolution to discover. Less complex phenotypes, on the other hand, are over-represented by genotypes, are easier to find, and frequently serve as stepping-stones for evolution.

q-bio.PE

Component-wise Analysis of Automatically Designed Multiobjective Algorithms on Constrained Problems

The performance of multiobjective algorithms varies across problems, making it hard to develop new algorithms or apply existing ones to new problems. To simplify the development and application of new multiobjective algorithms, there has been an increasing interest in their automatic design from component parts. These automatically designed metaheuristics can outperform their human-developed counterparts. However, it is still uncertain what are the most influential components leading to their performance improvement. This study introduces a new methodology to investigate the effects of the final configuration of an automatically designed algorithm. We apply this methodology to a well-performing Multiobjective Evolutionary Algorithm Based on Decomposition (MOEA/D) designed by the irace package on nine constrained problems. We then contrast the impact of the algorithm components in terms of their Search Trajectory Networks (STNs), the diversity of the population, and the hypervolume. Our results indicate that the most influential components were the restart and update strategies, with higher increments in performance and more distinct metric values. Also, their relative influence depends on the problem difficulty: not using the restart strategy was more influential in problems where MOEA/D performs better; while the update strategy was more influential in problems where MOEA/D performs the worst.

cs.NE

Search Trajectories Networks of Multiobjective Evolutionary Algorithms

Understanding the search dynamics of multiobjective evolutionary algorithms (MOEAs) is still an open problem. This paper extends a recent network-based tool, search trajectory networks (STNs), to model the behavior of MOEAs. Our approach uses the idea of decomposition, where a multiobjective problem is transformed into several single-objective problems. We show that STNs can be used to model and distinguish the search behavior of two popular multiobjective algorithms, MOEA/D and NSGA-II, using 10 continuous benchmark problems with 2 and 3 objectives. Our findings suggest that we can improve our understanding of MOEAs using STNs for algorithm analysis.

cs.NE

Local Optima Networks: A New Model of Combinatorial Fitness Landscapes

This chapter overviews a recently introduced network-based model of combinatorial landscapes: Local Optima Networks (LON). The model compresses the information given by the whole search space into a smaller mathematical object that is a graph having as vertices the local optima and as edges the possible weighted transitions between them. Two definitions of edges have been proposed: basin-transition and escape-edges, which capture relevant topological features of the underlying search spaces. This network model brings a new set of metrics to characterize the structure of combinatorial landscapes, those associated with the science of complex networks. These metrics are described, and results are presented of local optima network extraction and analysis for two selected combinatorial landscapes: NK landscapes and the quadratic assignment problem. Network features are found to correlate with and even predict the performance of heuristic search algorithms operating on these problems.

cs.NE

Local Optima Networks, Landscape Autocorrelation and Heuristic Search Performance

Recent developments in fitness landscape analysis include the study of Local Optima Networks (LON) and applications of the Elementary Landscapes theory. This paper represents a first step at combining these two tools to explore their ability to forecast the performance of search algorithms. We base our analysis on the Quadratic Assignment Problem (QAP) and conduct a large statistical study over 600 generated instances of different types. Our results reveal interesting links between the network measures, the autocorrelation measures and the performance of heuristic search algorithms.

cs.AI

Local optima networks and the performance of iterated local search

Local Optima Networks (LONs) have been recently proposed as an alternative model of combinatorial fitness landscapes. The model compresses the information given by the whole search space into a smaller mathematical object that is the graph having as vertices the local optima and as edges the possible weighted transitions between them. A new set of metrics can be derived from this model that capture the distribution and connectivity of the local optima in the underlying configuration space. This paper departs from the descriptive analysis of local optima networks, and actively studies the correlation between network features and the performance of a local search heuristic. The NK family of landscapes and the Iterated Local Search metaheuristic are considered. With a statistically-sound approach based on multiple linear regression, it is shown that some LONs' features strongly influence and can even partly predict the performance of a heuristic search algorithm. This study validates the expressive power of LONs as a model of combinatorial fitness landscapes.

cs.AI

Clustering of Local Optima in Combinatorial Fitness Landscapes

Using the recently proposed model of combinatorial landscapes: local optima networks, we study the distribution of local optima in two classes of instances of the quadratic assignment problem. Our results indicate that the two problem instance classes give rise to very different configuration spaces. For the so-called real-like class, the optima networks possess a clear modular structure, while the networks belonging to the class of random uniform instances are less well partitionable into clusters. We briefly discuss the consequences of the findings for heuristically searching the corresponding problem spaces.

cs.NE

Communities of Minima in Local Optima Networks of Combinatorial Spaces

In this work we present a new methodology to study the structure of the configuration spaces of hard combinatorial problems. It consists in building the network that has as nodes the locally optimal configurations and as edges the weighted oriented transitions between their basins of attraction. We apply the approach to the detection of communities in the optima networks produced by two different classes of instances of a hard combinatorial optimization problem: the quadratic assignment problem (QAP). We provide evidence indicating that the two problem instance classes give rise to very different configuration spaces. For the so-called real-like class, the networks possess a clear modular structure, while the optima networks belonging to the class of random uniform instances are less well partitionable into clusters. This is convincingly supported by using several statistical tests. Finally, we shortly discuss the consequences of the findings for heuristically searching the corresponding problem spaces.

cs.NE

First-improvement vs. Best-improvement Local Optima Networks of NK Landscapes

This paper extends a recently proposed model for combinatorial landscapes: Local Optima Networks (LON), to incorporate a first-improvement (greedy-ascent) hill-climbing algorithm, instead of a best-improvement (steepest-ascent) one, for the definition and extraction of the basins of attraction of the landscape optima. A statistical analysis comparing best and first improvement network models for a set of NK landscapes, is presented and discussed. Our results suggest structural differences between the two models with respect to both the network connectivity, and the nature of the basins of attraction. The impact of these differences in the behavior of search heuristics based on first and best improvement local search is thoroughly discussed.

cs.NE

Complex-network analysis of combinatorial spaces: The NK landscape case

We propose a network characterization of combinatorial fitness landscapes by adapting the notion of inherent networks proposed for energy surfaces. We use the well-known family of NK landscapes as an example. In our case the inherent network is the graph whose vertices represent the local maxima in the landscape, and the edges account for the transition probabilities between their corresponding basins of attraction. We exhaustively extracted such networks on representative NK landscape instances, and performed a statistical characterization of their properties. We found that most of these network properties are related to the search difficulty on the underlying NK landscapes with varying values of K.

cond-mat.stat-mech

HyFlex: A Benchmark Framework for Cross-domain Heuristic Search

Automating the design of heuristic search methods is an active research field within computer science, artificial intelligence and operational research. In order to make these methods more generally applicable, it is important to eliminate or reduce the role of the human expert in the process of designing an effective methodology to solve a given computational search problem. Researchers developing such methodologies are often constrained on the number of problem domains on which to test their adaptive, self-configuring algorithms; which can be explained by the inherent difficulty of implementing their corresponding domain specific software components. This paper presents HyFlex, a software framework for the development of cross-domain search methodologies. The framework features a common software interface for dealing with different combinatorial optimisation problems, and provides the algorithm components that are problem specific. In this way, the algorithm designer does not require a detailed knowledge the problem domains, and thus can concentrate his/her efforts in designing adaptive general-purpose heuristic search algorithms. Four hard combinatorial problems are fully implemented (maximum satisfiability, one dimensional bin packing, permutation flow shop and personnel scheduling), each containing a varied set of instance data (including real-world industrial applications) and an extensive set of problem specific heuristics and search operators. The framework forms the basis for the first International Cross-domain Heuristic Search Challenge (CHeSC), and it is currently in use by the international research community. In summary, HyFlex represents a valuable new benchmark of heuristic search generality, with which adaptive cross-domain algorithms are being easily developed, and reliably compared.

cs.AI