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Lecture notes in computer science

Learning qubo Models for Quantum Annealing: A Constraint-Based Approach

Florian Richoux, Jean-François Baffier, Philippe Codognet

Published Jan 1, 2023• 9 citations
Publisher
DOI
10.1007/978-3-031-36030-5_12

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This paper explores the applications of quantum annealing (QA) and classical simulated annealing (SA) to a suite of combinatorial optimization problems in machine learning, namely feature selection, instance selection, and clustering. We formulate each task as a Quadratic Unconstrained Binary Optimization (QUBO) problem and implement both quantum and classical solvers to compare their effectiveness. For feature selection, we propose several QUBO configurations that balance feature importance and redundancy, showing that quantum annealing (QA) produces solutions that are computationally more efficient. In instance selection, we propose a few novel heuristics for instance-level importance measures that extend existing methods. For clustering, we embed a classical-to-quantum pipeline, using classical clustering followed by QUBO-based medoid refinement, and demonstrate consistent improvements in cluster compactness and retrieval metrics. Our results suggest that QA can be a competitive and efficient tool for discrete machine learning optimization, even within the constraints of current quantum hardware.
We present experiments in solving constrained optimization and constraint satisfaction problems by means of Quantum Annealing in terms of QUBO (Quadratic Unconstrained Binary Optimization). We investigate different QUBO formulations for the encoding of integers into Booleans and for the encoding of the At-Most-One constraint, which is used in combinatorial problems requiring capacity constraints. We compare four different QUBO models and report experiments done on the D-Wave annealing computer and the "quantum-inspired" Fixstars Amplify Annealing Engine. For this, we consider a simple example taken from the domain of Constraint Satisfaction Problems (CSP), the N-queens problem, as its formulation involves multiple instances of the At-Most-One constraints.
Quantum Annealing is an alternative type of computation in which problems are encoded in quantum Hamiltonians (energy functions) and quantum dynamics is used to find solutions (ground states of minimal energy). Quantum computers such as the D-Wave systems are indeed implementing those ideas in hardware, as well as "quantum-inspired" devices based on classical electronics such as Fujitsu’s Digital Annealing Unit. All those systems use the same modeling language: Quadratic Unconstrained Binary Optimization (QUBO). However, QUBO is a low-level language and for modeling combinatorial problems such as constraint satisfaction and constrained optimization problems, we need to introduce higher-level abstractions in order to define complex constraints.