Modeling Hierarchical Spaces: A Review and Unified Framework for Surrogate-Based Architecture Design

Fuente: arXiv
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Auteurs principaux: Saves, Paul, Hallé-Hannan, Edward, Bussemaker, Jasper, Diouane, Youssef, Bartoli, Nathalie
Format: Preprint
Publié: 2025
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author Saves, Paul
Hallé-Hannan, Edward
Bussemaker, Jasper
Diouane, Youssef
Bartoli, Nathalie
author_facet Saves, Paul
Hallé-Hannan, Edward
Bussemaker, Jasper
Diouane, Youssef
Bartoli, Nathalie
contents Simulation-based problems involving mixed-variable inputs frequently feature domains that are hierarchical, conditional, heterogeneous, or tree-structured. These characteristics pose challenges for data representation, modeling, and optimization. This paper reviews extensive literature on these structured input spaces and proposes a unified framework that generalizes existing approaches. In this framework, input variables may be continuous, integer, or categorical. A variable is described as meta if its value governs the presence of other decreed variables, enabling the modeling of conditional and hierarchical structures. We further introduce the concept of partially-decreed variables, whose activation depends on contextual conditions. To capture these inter-variable hierarchical relationships, we introduce design space graphs, combining principles from feature modeling and graph theory. This allows the definition of general hierarchical domains suitable for describing complex system architectures. Our framework defines hierarchical distances and kernels to enable surrogate modeling and optimization on hierarchical domains. We demonstrate its effectiveness on complex system design problems, including a neural network and a green-aircraft case study. Our methods are available in the open-source Surrogate Modeling Toolbox (SMT 2.0).
format Preprint
id arxiv_https___arxiv_org_abs_2506_22621
institution arXiv
publishDate 2025
record_format arxiv
spellingShingle Modeling Hierarchical Spaces: A Review and Unified Framework for Surrogate-Based Architecture Design
Saves, Paul
Hallé-Hannan, Edward
Bussemaker, Jasper
Diouane, Youssef
Bartoli, Nathalie
Machine Learning
Optimization and Control
Simulation-based problems involving mixed-variable inputs frequently feature domains that are hierarchical, conditional, heterogeneous, or tree-structured. These characteristics pose challenges for data representation, modeling, and optimization. This paper reviews extensive literature on these structured input spaces and proposes a unified framework that generalizes existing approaches. In this framework, input variables may be continuous, integer, or categorical. A variable is described as meta if its value governs the presence of other decreed variables, enabling the modeling of conditional and hierarchical structures. We further introduce the concept of partially-decreed variables, whose activation depends on contextual conditions. To capture these inter-variable hierarchical relationships, we introduce design space graphs, combining principles from feature modeling and graph theory. This allows the definition of general hierarchical domains suitable for describing complex system architectures. Our framework defines hierarchical distances and kernels to enable surrogate modeling and optimization on hierarchical domains. We demonstrate its effectiveness on complex system design problems, including a neural network and a green-aircraft case study. Our methods are available in the open-source Surrogate Modeling Toolbox (SMT 2.0).
title Modeling Hierarchical Spaces: A Review and Unified Framework for Surrogate-Based Architecture Design
topic Machine Learning
Optimization and Control
url https://arxiv.org/abs/2506.22621