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Physical Review Letters

Classical Surrogates for Quantum Learning Models

Franz J. Schreiber, Jens Eisert, Johannes Jakob Meyer

Published Sep 7, 2023• 58 citations
Publisher

Abstract

The advent of noisy intermediate-scale quantum computers has put the search for possible applications to the forefront of quantum information science. One area where hopes for an advantage through near-term quantum computers are high is quantum machine learning, where variational quantum learning models based on parametrized quantum circuits are discussed. In this work, we introduce the concept of a classical surrogate, a classical model which can be efficiently obtained from a trained quantum learning model and reproduces its input-output relations. As inference can be performed classically, the existence of a classical surrogate greatly enhances the applicability of a quantum learning strategy. However, the classical surrogate also challenges possible advantages of quantum schemes. As it is possible to directly optimize the Ansatz of the classical surrogate, they create a natural benchmark the quantum model has to outperform. We show that large classes of well-analyzed reuploading models have a classical surrogate. We conducted numerical experiments and found that these quantum models show no advantage in performance or trainability in the problems we analyze. This leaves only generalization capability as a possible point of quantum advantage and emphasizes the dire need for a better understanding of inductive biases of quantum learning models.

DOI
10.1103/physrevlett.131.100803

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The advent of noisy intermediate-scale quantum computers has put the search for possible applications to the forefront of quantum information science. One area where hopes for an advantage through near-term quantum computers are high is quantum machine learning, where variational quantum learning models based on parametrized quantum circuits are discussed. In this work, we introduce the concept of a classical surrogate, a classical model which can be efficiently obtained from a trained quantum learning model and reproduces its input-output relations. As inference can be performed classically, the existence of a classical surrogate greatly enhances the applicability of a quantum learning strategy. However, the classical surrogate also challenges possible advantages of quantum schemes. As it is possible to directly optimize the Ansatz of the classical surrogate, they create a natural benchmark the quantum model has to outperform. We show that large classes of well-analyzed reuploading models have a classical surrogate. We conducted numerical experiments and found that these quantum models show no advantage in performance or trainability in the problems we analyze. This leaves only generalization capability as a possible point of quantum advantage and emphasizes the dire need for a better understanding of inductive biases of quantum learning models.
The advent of noisy intermediate-scale quantum computers has put the search for possible applications to the forefront of quantum information science. One area where hopes for an advantage through near-term quantum computers are high is quantum machine learning, where variational quantum learning models based on parametrized quantum circuits are discussed. In this work, we introduce the concept of a classical surrogate, a classical model which can be efficiently obtained from a trained quantum learning model and reproduces its input-output relations. As inference can be performed classically, the existence of a classical surrogate greatly enhances the applicability of a quantum learning strategy. However, the classical surrogate also challenges possible advantages of quantum schemes. As it is possible to directly optimize the Ansatz of the classical surrogate, they create a natural benchmark the quantum model has to outperform. We show that large classes of well-analyzed reuploading models have a classical surrogate. We conducted numerical experiments and found that these quantum models show no advantage in performance or trainability in the problems we analyze. This leaves only generalization capability as a possible point of quantum advantage and emphasizes the dire need for a better understanding of inductive biases of quantum learning models.
Abstract Surrogates have been proposed as classical simulations of the pretrained quantum learning models, which are capable of mimicking the input-output relation inherent in the quantum model. Quantum hardware within this framework is used for training and for generating the classical surrogates. Inference is relegated to the classical surrogate, hence alleviating the extra quantum computational cost once training is done. Taking inspiration from interpretable models, we introduce a local surrogation protocol based on reuploading-type quantum learning models, including local quantum surrogates as cost-efficient intermediate quantum learning models. When the training and inference are only concerned with a subregion of the data space, deploying a local quantum surrogate offers qubit cost reductions and the downstream local classical surrogate achieves dequantization of the inference phase. Several numerical experiments are presented.
Variational quantum algorithms are a class of techniques intended to be used on near-term quantum computers. The goal of these algorithms is to perform large quantum computations by breaking the problem down into a large number of shallow quantum circuits, complemented by classical optimization and feedback between each circuit execution. One path for improving the performance of these algorithms is to enhance the classical optimization technique. Given the relative ease and abundance of classical computing resources, there is ample opportunity to do so. In this work, we introduce the idea of learning surrogate models for variational circuits using a few experimental measurements, and then performing parameter optimization using these models as opposed to the original data. We demonstrate this idea using a surrogate model based on kernel approximations, through which we reconstruct local patches of variational cost functions using batches of noisy quantum circuit results. Through application to the quantum approximate optimization algorithm and preparation of ground states for molecules, we demonstrate the superiority of surrogate-based optimization over commonly used optimization techniques for variational algorithms.
Abstract Quantum Machine Learning algorithms based on Variational Quantum Circuits (VQCs) are important candidates for useful application of quantum computing. It is known that a VQC is a linear model in a feature space determined by its architecture. Such models can be compared to classical ones using various sets of tools, and surrogate models designed to classically approximate their results were proposed. At the same time, quantum advantages for learning tasks have been proven in the case of discrete data distributions and cryptography primitives. In this work, we propose a framework to avoid Random Feature approximation techniques. Using previous results, we establish conditions on the weight vectors of the quantum models that are necessary to avoid these dequantization methods. We show that this theory is compatible with previously proven quantum advantages on discrete inputs, and provides examples of advantages for continuous inputs. This separation is connected to large weight vector norm, and we suggest that this can only happen with a high dimensional feature map. Our results demonstrate that it is possible to design quantum models that cannot be classically approximated with good generalization. In addition, we provide a method to verify that the necessary condition is respected for a quantum model. Finally, we discuss how concentration issues must be considered to design such instances. We expect that our work will be a starting point to design near-term quantum models that avoid dequantization methods by ensuring non-classical convergence properties, and to identify existing quantum models that can be classically approximated.
The rapid advancement of quantum computing hardware and software has ushered in a new era for computational science, promising to tackle problems that are intractable for classical computers. Parallelly, machine learning (ML) has revolutionized data analysis and artificial intelligence. The confluence of these two fields, known as Quantum Machine Learning (QML), aims to harness the principles of quantum mechanics-such as superposition, entanglement, and interference-to enhance and redefine classical machine learning algorithms. This survey provides a comprehensive overview of the burgeoning field of QML. We begin by elucidating the fundamental quantum concepts that underpin QML approaches. We then present a detailed taxonomy and analysis of prominent QML algorithms, categorizing them into quantum-enhanced classical models and fully quantum models. Key families of algorithms discussed include Quantum Support Vector Machines (QSVM), Quantum Neural Networks (QNNs), and Quantum Generative Adversarial Networks (QGANs). For each, we explain the theoretical quantum advantage, the circuit implementation, and the current limitations. Furthermore, we delve into the critical challenges facing the practical realization of QML, including the pervasive issue of noise in Noisy Intermediate-Scale Quantum (NISQ) devices, the problem of barren plateaus in training quantum circuits, and the complexities of efficient data encoding (quantum feature maps). We also present a small-scale experimental simulation of a variational quantum classifier on a standardized dataset, demonstrating its principle and comparing its performance with a classical counterpart. Finally, the paper discusses the future trajectory of QML, highlighting the importance of error mitigation, hybrid quantum-classical architectures, and the development of quantum-specific learning inductive biases. We conclude that while fault-tolerant quantum computers remain on the horizon, QML represents a paradigm shift with the potential to deliver profound computational advantages in the coming decades.
For quantum machine learning, the exact boundary between classical and quantum advantage is still poorly understood. Direct comparison between quantum neural networks (QNNs) and existing classical models, which encompass fundamentally different function classes, often fails to provide broader insight into the difference between the two. Inspired by the techniques of Neural Quantum States and Random Fourier Features, this work introduces Neural Fourier Surrogates (NFS), a stochastic classical neural network architecture for efficiently learning coefficients over the same finite Fourier series support as quantum neural networks. Testing on a selection of tabular benchmark datasets, we find that NFS is an effective classifier architecture broadly competitive with established classical baselines, including a comparable Random Fourier Features model, and possessing comparable performance to data-reuploading QNNs; combined with additional analysis comparing the learned Fourier spectra of QNNs and NFS on synthetic data, these results establish NFS as a natural classical baseline for evaluating QNN performance.