Quantum algorithms for solving a wide range of practical problems have been proposed in the last ten years, such as data search and analysis, product recommendation, and credit scoring. The concern about privacy and other ethical issues in quantum computing naturally rises up. In this paper, we define a formal framework for detecting violations of differential privacy for quantum algorithms. A detection algorithm is developed to verify whether a (noisy) quantum algorithm is differentially private and automatically generate bugging information when the violation of differential privacy is reported. The information consists of a pair of quantum states that violate the privacy, to illustrate the cause of the violation. Our algorithm is equipped with Tensor Networks, a highly efficient data structure, and executed both on TensorFlow Quantum and TorchQuantum which are the quantum extensions of famous machine learning platforms -- TensorFlow and PyTorch, respectively. The effectiveness and efficiency of our algorithm are confirmed by the experimental results of almost all types of quantum algorithms already implemented on realistic quantum computers, including quantum supremacy algorithms (beyond the capability of classical algorithms), quantum machine learning models, quantum approximate optimization algorithms, and variational quantum eigensolvers with up to 21 quantum bits.
Quantum machine learning (QML) represents a promising frontier in the quantum technologies. In this pursuit of quantum advantage, the quantum kernel method for support vector machine has emerged as a powerful approach. Entanglement, a fundamental concept in quantum mechanics, assumes a central role in quantum computing. In this paper, we investigate the optimal number of entanglement gates in the quantum kernel feature maps by a multi-objective genetic algorithm. We distinct the fitness functions of genetic algorithm for non-local gates for entanglement and local gates to gain insights into the benefits of employing entanglement gates. Our experiments reveal that the optimal configuration of quantum circuits for the quantum kernel method incorporates a proportional number of non-local gates for entanglement. The result complements the prior literature on quantum kernel generation where non-local gates were largely suppressed. Furthermore, we demonstrate that the separability indexes of data can be leveraged to estimate the number of non-local gates required for the quantum support vector machine's feature maps. This insight can be helpful in selecting appropriate parameters, such as the entanglement parameter, in various quantum programming packages like https://qiskit.org/ based on data analysis. Our findings offer valuable guidance for enhancing the efficiency and accuracy of quantum machine learning algorithms.
The field of drug discovery hinges on the accurate prediction of binding affinity between prospective drug molecules and target proteins, especially when such proteins directly influence disease progression. However, estimating binding affinity demands significant financial and computational resources. While state-of-the-art methodologies employ classical machine learning (ML) techniques, emerging hybrid quantum machine learning (QML) models have shown promise for enhanced performance, owing to their inherent parallelism and capacity to manage exponential increases in data dimensionality. Despite these advances, existing models encounter issues related to convergence stability and prediction accuracy. This paper introduces a novel hybrid quantum-classical deep learning model tailored for binding affinity prediction in drug discovery. Specifically, the proposed model synergistically integrates 3D and spatial graph convolutional neural networks within an optimized quantum architecture. Simulation results demonstrate a 6% improvement in prediction accuracy relative to existing classical models, as well as a significantly more stable convergence performance compared to previous classical approaches.
Parameterized quantum circuits as machine learning models are typically well described by their representation as a partial Fourier series of the input features, with frequencies uniquely determined by the feature map's generator Hamiltonians. Ordinarily, these data-encoding generators are chosen in advance, fixing the space of functions that can be represented. In this work we consider a generalization of quantum models to include a set of trainable parameters in the generator, leading to a trainable frequency (TF) quantum model. We numerically demonstrate how TF models can learn generators with desirable properties for solving the task at hand, including non-regularly spaced frequencies in their spectra and flexible spectral richness. Finally, we showcase the real-world effectiveness of our approach, demonstrating an improved accuracy in solving the Navier-Stokes equations using a TF model with only a single parameter added to each encoding operation. Since TF models encompass conventional fixed frequency models, they may offer a sensible default choice for variational quantum machine learning.
Quantum machine learning (QML) shows promise for analyzing quantum data. A notable example is the use of quantum convolutional neural networks (QCNNs), implemented as specific types of quantum circuits, to recognize phases of matter. In this approach, ground states of many-body Hamiltonians are prepared to form a quantum dataset and classified in a supervised manner using only a few labeled examples. However, this type of dataset and model differs fundamentally from typical QML paradigms based on feature maps and parameterized circuits. In this study, we demonstrate how models utilizing quantum data can be interpreted through hidden feature maps, where physical features are implicitly embedded via ground-state feature maps. By analyzing selected examples previously explored with QCNNs, we show that high performance in quantum phase recognition comes from generating a highly effective basis set with sharp features at critical points. The learning process adapts the measurement to create sharp decision boundaries. Our analysis highlights improved generalization when working with quantum data, particularly in the limited-shots regime. Furthermore, translating these insights into the domain of quantum scientific machine learning, we demonstrate that ground-state feature maps can be applied to fluid dynamics problems, expressing shock wave solutions with good generalization and proven trainability.
Quantum variational circuits have gained significant attention due to their applications in the quantum approximate optimization algorithm and quantum machine learning research. This work introduces a novel class of classical probabilistic circuits designed for generating approximate solutions to combinatorial optimization problems constructed using two-bit stochastic matrices. Through a numerical study, we investigate the performance of our proposed variational circuits in solving the Max-Cut problem on various graphs of increasing sizes. Our classical algorithm demonstrates improved performance for several graph types to the quantum approximate optimization algorithm. Our findings suggest that evaluating the performance of quantum variational circuits against variational circuits with sub-universal gate sets is a valuable benchmark for identifying areas where quantum variational circuits can excel.
Over the past few years, there has been significant interest in Quantum Machine Learning (QML) among researchers, as it has the potential to transform the field of machine learning. Several models that exploit the properties of quantum mechanics have been developed for practical applications. In this study, we investigated the application of our previously proposed quantum pre-processing filter (QPF) to binary image classification. We evaluated the QPF on four datasets: MNIST (handwritten digits), EMNIST (handwritten digits and alphabets), CIFAR-10 (photographic images) and GTSRB (real-life traffic sign images). Similar to our previous multi-class classification results, the application of QPF improved the binary image classification accuracy using neural network against MNIST, EMNIST, and CIFAR-10 from 98.9% to 99.2%, 97.8% to 98.3%, and 71.2% to 76.1%, respectively, but degraded it against GTSRB from 93.5% to 92.0%. We then applied QPF in cases using a smaller number of training and testing samples, i.e. 80 and 20 samples per class, respectively. In order to derive statistically stable results, we conducted the experiment with 100 trials choosing randomly different training and testing samples and averaging the results. The result showed that the application of QPF did not improve the image classification accuracy against MNIST and EMNIST but improved it against CIFAR-10 and GTSRB from 65.8% to 67.2% and 90.5% to 91.8%, respectively. Further research will be conducted as part of future work to investigate the potential of QPF to assess the scalability of the proposed approach to larger and complex datasets.
Self-Attention Mechanism (SAM) excels at distilling important information from the interior of data to improve the computational efficiency of models. Nevertheless, many Quantum Machine Learning (QML) models lack the ability to distinguish the intrinsic connections of information like SAM, which limits their effectiveness on massive high-dimensional quantum data. To tackle the above issue, a Quantum Kernel Self-Attention Mechanism (QKSAM) is introduced to combine the data representation merit of Quantum Kernel Methods (QKM) with the efficient information extraction capability of SAM. Further, a Quantum Kernel Self-Attention Network (QKSAN) framework is proposed based on QKSAM, which ingeniously incorporates the Deferred Measurement Principle (DMP) and conditional measurement techniques to release half of quantum resources by mid-circuit measurement, thereby bolstering both feasibility and adaptability. Simultaneously, the Quantum Kernel Self-Attention Score (QKSAS) with an exponentially large characterization space is spawned to accommodate more information and determine the measurement conditions. Eventually, four QKSAN sub-models are deployed on PennyLane and IBM Qiskit platforms to perform binary classification on MNIST and Fashion MNIST, where the QKSAS tests and correlation assessments between noise immunity and learning ability are executed on the best-performing sub-model. The paramount experimental finding is that a potential learning advantage is revealed in partial QKSAN subclasses that acquire an impressive more than 98.05% high accuracy with very few parameters that are much less in aggregate than classical machine learning models. Predictably, QKSAN lays the foundation for future quantum computers to perform machine learning on massive amounts of data while driving advances in areas such as quantum computer vision.
Quantum-inspired Machine Learning (QiML) is a burgeoning field, receiving global attention from researchers for its potential to leverage principles of quantum mechanics within classical computational frameworks. However, current review literature often presents a superficial exploration of QiML, focusing instead on the broader Quantum Machine Learning (QML) field. In response to this gap, this survey provides an integrated and comprehensive examination of QiML, exploring QiML's diverse research domains including tensor network simulations, dequantized algorithms, and others, showcasing recent advancements, practical applications, and illuminating potential future research avenues. Further, a concrete definition of QiML is established by analyzing various prior interpretations of the term and their inherent ambiguities. As QiML continues to evolve, we anticipate a wealth of future developments drawing from quantum mechanics, quantum computing, and classical machine learning, enriching the field further. This survey serves as a guide for researchers and practitioners alike, providing a holistic understanding of QiML's current landscape and future directions.
Quantum machine learning and vision have come to the fore recently, with hardware advances enabling rapid advancement in the capabilities of quantum machines. Recently, quantum image generation has been explored with many potential advantages over non-quantum techniques; however, previous techniques have suffered from poor quality and robustness. To address these problems, we introduce, MosaiQ, a high-quality quantum image generation GAN framework that can be executed on today's Near-term Intermediate Scale Quantum (NISQ) computers.
Quantum State Tomography (QST) is a fundamental technique in Quantum Information Processing (QIP) for reconstructing unknown quantum states. However, the conventional QST methods are limited by the number of measurements required, which makes them impractical for large-scale quantum systems. To overcome this challenge, we propose the integration of Quantum Machine Learning (QML) techniques to enhance the efficiency of QST. In this paper, we conduct a comprehensive investigation into various approaches for QST, encompassing both classical and quantum methodologies; We also implement different QML approaches for QST and demonstrate their effectiveness on various simulated and experimental quantum systems, including multi-qubit networks. Our results show that our QML-based QST approach can achieve high fidelity (98%) with significantly fewer measurements than conventional methods, making it a promising tool for practical QIP applications.
A limited set of tools exist for assessing whether the behavior of quantum machine learning models diverges from conventional models, outside of abstract or theoretical settings. We present a systematic application of explainable artificial intelligence techniques to analyze synthetic data generated from a hybrid quantum-classical neural network adapted from twenty different real-world data sets, including solar flares, cardiac arrhythmia, and speech data. Each of these data sets exhibits varying degrees of complexity and class imbalance. We benchmark the quantum-generated data relative to state-of-the-art methods for mitigating class imbalance for associated classification tasks. We leverage this approach to elucidate the qualities of a problem that make it more or less likely to be amenable to a hybrid quantum-classical generative model.
Quantum machine learning (QML) is a cross-disciplinary subject made up of two of the most exciting research areas: quantum computing and classical machine learning (ML), with ML and artificial intelligence (AI) being projected as the first fields that will be impacted by the rise of quantum machines. Quantum computers are being used today in drug discovery, material & molecular modelling and finance. In this work, we discuss some upcoming active new research areas in application of quantum machine learning (QML) in finance. We discuss certain QML models that has become areas of active interest in the financial world for various applications. We use real world financial dataset and compare models such as qGAN (quantum generative adversarial networks) and QCBM (quantum circuit Born machine) among others, using simulated environments. For the qGAN, we define quantum circuits for discriminators and generators and show promises of future quantum advantage via QML in finance.
Quantum machine learning has the potential to enable advances in artificial intelligence, such as solving problems intractable on classical computers. Some fundamental ideas behind quantum machine learning are similar to kernel methods in classical machine learning. Both process information by mapping it into high-dimensional vector spaces without explicitly calculating their numerical values. We explore a setup for performing classification on labeled classical datasets, consisting of a classical neural network connected to a quantum annealer. The neural network programs the quantum annealer's controls and thereby maps the annealer's initial states into new states in the Hilbert space. The neural network's parameters are optimized to maximize the distance of states corresponding to inputs from different classes and minimize the distance between quantum states corresponding to the same class. Recent literature showed that at least some of the "learning" is due to the quantum annealer, connecting a small linear network to a quantum annealer and using it to learn small and linearly inseparable datasets. In this study, we consider a similar but not quite the same case, where a classical fully-fledged neural network is connected with a small quantum annealer. In such a setting, the fully-fledged classical neural-network already has built-in nonlinearity and learning power, and can already handle the classification problem alone, we want to see whether an additional quantum layer could boost its performance. We simulate this system to learn several common datasets, including those for image and sound recognition. We conclude that adding a small quantum annealer does not provide a significant benefit over just using a regular (nonlinear) classical neural network.
In this research, a comparative study of four Quantum Machine Learning (QML) models was conducted for fraud detection in finance. We proved that the Quantum Support Vector Classifier model achieved the highest performance, with F1 scores of 0.98 for fraud and non-fraud classes. Other models like the Variational Quantum Classifier, Estimator Quantum Neural Network (QNN), and Sampler QNN demonstrate promising results, propelling the potential of QML classification for financial applications. While they exhibit certain limitations, the insights attained pave the way for future enhancements and optimisation strategies. However, challenges exist, including the need for more efficient Quantum algorithms and larger and more complex datasets. The article provides solutions to overcome current limitations and contributes new insights to the field of Quantum Machine Learning in fraud detection, with important implications for its future development.
Benchmarking of quantum machine learning (QML) algorithms is challenging due to the complexity and variability of QML systems, e.g., regarding model ansatzes, data sets, training techniques, and hyper-parameters selection. The QUantum computing Application benchmaRK (QUARK) framework simplifies and standardizes benchmarking studies for quantum computing applications. Here, we propose several extensions of QUARK to include the ability to evaluate the training and deployment of quantum generative models. We describe the updated software architecture and illustrate its flexibility through several example applications: (1) We trained different quantum generative models using several circuit ansatzes, data sets, and data transformations. (2) We evaluated our models on GPU and real quantum hardware. (3) We assessed the generalization capabilities of our generative models using a broad set of metrics that capture, e.g., the novelty and validity of the generated data.
We propose a high-rate scheme for discretely-modulated continuous-variable quantum key distribution (DM CVQKD) using quantum machine learning technologies, which divides the whole CVQKD system into three parts, i.e., the initialization part that is used for training and estimating quantum classifier, the prediction part that is used for generating highly correlated raw keys, and the data-postprocessing part that generates the final secret key string shared by Alice and Bob. To this end, a low-complexity quantum k-nearest neighbor (QkNN) classifier is designed for predicting the lossy discretely-modulated coherent states (DMCSs) at Bob's side. The performance of the proposed QkNN-based CVQKD especially in terms of machine learning metrics and complexity is analyzed, and its theoretical security is proved by using semi-definite program (SDP) method. Numerical simulation shows that the secret key rate of our proposed scheme is explicitly superior to the existing DM CVQKD protocols, and it can be further enhanced with the increase of modulation variance.
Anomaly detection (AD) involves identifying observations or events that deviate in some way from the rest of the data. Machine learning techniques have shown success in automating this process by detecting hidden patterns and deviations in large-scale data. The potential of quantum computing for machine learning has been widely recognized, leading to extensive research efforts to develop suitable quantum machine learning (QML) algorithms. In particular, the search for QML algorithms for near-term NISQ devices is in full swing. However, NISQ devices pose additional challenges due to their limited qubit coherence times, low number of qubits, and high error rates. Kernel methods based on quantum kernel estimation have emerged as a promising approach to QML on NISQ devices, offering theoretical guarantees, versatility, and compatibility with NISQ constraints. Especially support vector machines (SVM) utilizing quantum kernel estimation have shown success in various supervised learning tasks. However, in the context of AD, semisupervised learning is of great relevance, and yet there is limited research published in this area. This paper introduces an approach to semisupervised AD based on the reconstruction loss of a support vector regression (SVR) with quantum kernel. This novel model is an alternative to the variational quantum and quantum kernel one-class classifiers, and is compared to a quantum autoencoder as quantum baseline and a SVR with radial-basis-function (RBF) kernel as well as a classical autoencoder as classical baselines. The models are benchmarked extensively on 10 real-world AD data sets and one toy data set, and it is shown that our SVR model with quantum kernel performs better than the SVR with RBF kernel as well as all other models, achieving highest mean AUC over all data sets. In addition, our QSVR outperforms the quantum autoencoder on 9 out of 11 data sets.
Quantum computers possess the potential to process data using a remarkably reduced number of qubits compared to conventional bits, as per theoretical foundations. However, recent experiments have indicated that the practical feasibility of retrieving an image from its quantum encoded version is currently limited to very small image sizes. Despite this constraint, variational quantum machine learning algorithms can still be employed in the current noisy intermediate scale quantum (NISQ) era. An example is a hybrid quantum machine learning approach for edge detection. In our study, we present an application of quantum transfer learning for detecting cracks in gray value images. We compare the performance and training time of PennyLane's standard qubits with IBM's qasm\_simulator and real backends, offering insights into their execution efficiency.
Managing the response to natural disasters effectively can considerably mitigate their devastating impact. This work explores the potential of using supervised hybrid quantum machine learning to optimize emergency evacuation plans for cars during natural disasters. The study focuses on earthquake emergencies and models the problem as a dynamic computational graph where an earthquake damages an area of a city. The residents seek to evacuate the city by reaching the exit points where traffic congestion occurs. The situation is modeled as a shortest-path problem on an uncertain and dynamically evolving map. We propose a novel hybrid supervised learning approach and test it on hypothetical situations on a concrete city graph. This approach uses a novel quantum feature-wise linear modulation (FiLM) neural network parallel to a classical FiLM network to imitate Dijkstra's node-wise shortest path algorithm on a deterministic dynamic graph. Adding the quantum neural network in parallel increases the overall model's expressivity by splitting the dataset's harmonic and non-harmonic features between the quantum and classical components. The hybrid supervised learning agent is trained on a dataset of Dijkstra's shortest paths and can successfully learn the navigation task. The hybrid quantum network improves over the purely classical supervised learning approach by 7% in accuracy. We show that the quantum part has a significant contribution of 45.(3)% to the prediction and that the network could be executed on an ion-based quantum computer. The results demonstrate the potential of supervised hybrid quantum machine learning in improving emergency evacuation planning during natural disasters.