Hardware-efficient circuits employed in Quantum Machine Learning are typically composed of alternating layers of uniformly applied gates. High-speed numerical simulators for such circuits are crucial for advancing research in this field. In this work, we numerically benchmark universal and gate-specific techniques for simulating the action of layers of gates on quantum state vectors, aiming to accelerate the overall simulation of Quantum Machine Learning algorithms. Our analysis shows that the optimal simulation method for a given layer of gates depends on the number of qubits involved, and that a tailored combination of techniques can yield substantial performance gains in the forward and backward passes for a given circuit. Building on these insights, we developed a numerical simulator, named TQml Simulator, that employs the most efficient simulation method for each layer in a given circuit. We evaluated TQml Simulator on circuits constructed from standard gate sets, such as rotations and CNOTs, as well as on native gates from IonQ and IBM quantum processing units. In most cases, our simulator outperforms equivalent Pennylane's default.qubit simulator by up to a factor of 10, depending on the circuit, the number of qubits, the batch size of the input data, and the hardware used.
Hardware-efficient circuits employed in Quantum Machine Learning are typically composed of alternating layers of uniformly applied gates. High-speed numerical simulators for such circuits are crucial for advancing research in this field. In this work, we numerically benchmark universal and gate-specific techniques for simulating the action of layers of gates on quantum state vectors, aiming to accelerate the overall simulation of Quantum Machine Learning algorithms. Our analysis shows that the optimal simulation method for a given layer of gates depends on the number of qubits involved, and that a tailored combination of techniques can yield substantial performance gains in the forward and backward passes for a given circuit. Building on these insights, we developed a numerical simulator, named TQml Simulator, that employs the most efficient simulation method for each layer in a given circuit. We evaluated TQml Simulator on circuits constructed from standard gate sets, such as rotations and CNOTs, as well as on native gates from IonQ and IBM quantum processing units. In most cases, our simulator outperforms equivalent Pennylane's default.qubit simulator by up to a factor of 10, depending on the circuit, the number of qubits, the batch size of the input data, and the hardware used.
Modern quantum machine learning (QML) methods involve variationally optimizing a parameterized quantum circuit on a training data set, and subsequently making predictions on a testing data set (i.e., generalizing). In this work, we provide a comprehensive study of generalization performance in QML after training on a limited number N of training data points. We show that the generalization error of a quantum machine learning model with T trainable gates scales at worst as [Formula: see text]. When only K ≪ T gates have undergone substantial change in the optimization process, we prove that the generalization error improves to [Formula: see text]. Our results imply that the compiling of unitaries into a polynomial number of native gates, a crucial application for the quantum computing industry that typically uses exponential-size training data, can be sped up significantly. We also show that classification of quantum states across a phase transition with a quantum convolutional neural network requires only a very small training data set. Other potential applications include learning quantum error correcting codes or quantum dynamical simulation. Our work injects new hope into the field of QML, as good generalization is guaranteed from few training data.
Machine Learning (ML) has been widely applied across numerous domains due to its ability to automatically identify informative patterns from data for various tasks. The availability of large-scale data and advanced computational power enables the development of sophisticated models and training strategies, leading to state-of-the-art performance, but it also introduces substantial challenges. Quantum Computing (QC), which exploits quantum mechanisms for computation, has attracted growing attention and significant global investment as it may address these challenges. Consequently, Quantum Machine Learning (QML), the integration of these two fields, has received increasing interest, with a notable rise in related studies in recent years. We are motivated to review these existing contributions regarding quantum circuit-based learning models for classical data analysis and highlight the identified potentials and challenges of this technique. Specifically, we focus not only on QML models, both kernel-based and neural network-based, but also on recent explorations of their integration with classical machine learning layers within hybrid frameworks. Moreover, we examine both theoretical analysis and empirical findings to better understand their capabilities, and we also discuss the efforts on noise-resilient and hardware-efficient QML that could enhance its practicality under current hardware limitations. In addition, we cover several emerging paradigms for advanced quantum circuit design and highlight the adaptability of QML across representative application domains. This study aims to provide an overview of the contributions made to bridge quantum computing and machine learning, offering insights and guidance to support its future development and pave the way for broader adoption in the coming years.
Quantum machine learning (QML) has emerged as a promising field, combining the power of quantum computing with classical machine learning techniques to solve complex computational tasks. As the demand for efficient quantum simulations grows, multiple QML frameworks, including PennyLane, Qiskit, and TensorFlow Quantum (TFQ), have been developed to facilitate hybrid quantum-classical computations. This study aims to evaluate and compare the performance of three leading QML frameworks PennyLane, Qiskit, and TensorFlow Quantum in simulating quantum machine learning models, focusing on accuracy, execution time, and noise tolerance. The study examined three leading quantum machine learning (QML) frameworks PennyLane (v0.24), Qiskit (v0.43.2), and TensorFlow Quantum (TFQ, v0.7) each tested on a 64-bit Ubuntu Linux system with an Intel Core i7 processor, 32 GB RAM, and NVIDIA GeForce RTX 3080 GPU. Quantum algorithms like variational quantum circuits (VQCs) and quantum support vector machines (QSVMs) were simulated using these frameworks. Various quantum gates, including Pauli-X, Y, Z, Hadamard, CNOT, and Rotation gates (Rx, Ry, Rz), were used for parameter optimization and quantum superposition. The Iris and MNIST datasets were adapted for quantum encoding using Amplitude and Angle Encoding for binary classification tasks. Simulations were run on classical computers, while select circuits were executed on IBM Quantum’s Falcon r5.11 processor to compare hardware performance. PennyLane achieved the highest accuracy (92%) in quantum simulations, excelling in hybrid quantum-classical model integration. TensorFlow Quantum provided the fastest execution time, especially in classical simulations, making it suitable for rapid prototyping. Qiskit produced deeper quantum circuits but had higher error rates (6%) on real quantum hardware, highlighting noise and decoherence effects. The VQC models optimized by stochastic gradient descent (SGD) showed significant improvements in model performance, and QSVMs effectively classified both linearly separable and non-separable datasets, demonstrating the potential of quantum algorithms over classical approaches. Statistical analysis confirmed the significance of the results (p < 0.05). PennyLane is the most robust framework for hybrid quantum-classical models, while TensorFlow Quantum is suited for rapid prototyping. Qiskit, despite longer execution times, excels in hardware implementation. The choice of framework should align with the specific needs of quantum machine learning tasks.
Recent demonstrations of superconducting quantum computers by Google and IBM and trapped-ion computers from IonQ fueled new research in quantum algorithms, compilation into quantum circuits, and empirical algorithmics. While online access to quantum hardware remains too limited to meet the demand, simulating quantum circuits on conventional computers satisfies many needs. We advance Schrödinger-style simulation of quantum circuits that is useful standalone and as a building block in layered simulation algorithms, both cases are illustrated in our results. Our algorithmic contributions show how to simulate multiple quantum gates at once, how to avoid floating-point multiplies, how to best use data-level and thread-level parallelism as well as CPU cache, and how to leverage these optimizations by reordering circuit gates. While not described previously, these techniques implemented by us supported published high-performance distributed simulations up to 64 qubits. To show additional impact, we benchmark our simulator against Microsoft, IBM and Google simulators on hard circuits from Google.
Recent advances in Quantum Machine Learning (QML) bring together Quantum Computing and Machine Learning with the aim of enhancing the advantages of Machine Learning to solve problems efficiently. The properties of quantum systems (superposition, entanglement, etc.) to represent multiple states of information at once, QML can potentially offer significant advantages when solving complex high-dimensional (multidimensional) computational problems. This paper reviews the current state-of-art regarding QML in general through an organized compilation and assessment of selected studies recently published in scientific literature that were found via large electronic library catalogs based on peer-reviewed sources according to algorithms used, optimization approaches employed, and areas of applied study. This review provides comparative analyses of each selected studies for purposes of identifying major trends in QML research/practice as well as opportunities for methodological improvements and challenges still existing within QML. Finally, this review presents an overview of Quantum Computing and Quantum Data Encoding Principles utilized to translate Classical Data into Quantum States as a high-level evaluation of several popular Quantum Learning Algorithms (e.g., Quantum Neural Networks, Quantum Support Machines, and Variational Quantum Circuit). The survey describes the optimization strategies such as gradient based techniques, Bayesian Optimization and evolutionary techniques being used to improve the stability of the quantum machine learning (QML) training process. Then, it provides examples of application areas for such QML, where healthcare analytics, environmental modelling, manufacturing optimization and analysis of biologic data are included. The comparative review of the recent academic research has identified several limitations and challenges regarding the use of QML that researchers. Although QML is believed to be capable of solving complex computational problems, issues such as noise in hardware, limited numbers of qubits and scalability present significant challenges for researchers working with this type of machine learning application. Overall, it appears that this survey provides a broad overview of contemporary developments and future trends for developing high-performance quantum learning systems.
Quantum software engineering is an emerging research field focusing on efficiently embedding the quantum programming paradigm into existing software ecosystems. A key aspect of this field is the realization of quantum algorithms using gate-based programming and the subsequent low-level optimization of the resulting quantum circuits, a process that is commonly performed by so-called transpilation pipelines. One significant challenge in these pipelines is determining which optimizations to apply to a given circuit. This decision is usually based on fixed default configurations that are uniformly applied to all circuits, frequently resulting in missed opportunities for more aggressive circuit optimization. In this work, we tackle this challenge by applying autotuning with supervised machine learning to develop an automated method for selection of transpiler passes. To train our machine-learning models, we employ feature-model based sampling to generate a representative dataset that examines how different combinations of Qiskit transpiler passes perform across thousands of circuits drawn from the state-of-the-art benchmarking suite MQT Bench. Using these data, we build a predictive model extension for the Qiskit transpilation pipeline that uses a machine learning model to automatically select combinations of transpiler passes aiming to achieve a maximum reduction in two-qubit gates. Our empirical evaluation shows that the combinations selected by our model are never outperformed by Qiskit's optimization levels, achieve on average an additional 19.1% - 32.4% reduction in two-qubit gates, and for some circuits finds reductions of up to 95.8% in cases where Qiskit achieves no reduction at all.