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This paper presents a novel approach to quantum architecture search by integrating the techniques of ZX-calculus with Genetic Programming (GP) to optimize the structure of parameterized quantum circuits employed in Quantum Machine Learning…

Quantum Physics · Physics 2025-03-21 Tom Ewen , Ivica Turkalj , Patrick Holzer , Mark-Oliver Wolf

Variational Quantum Circuits (VQCs), or the so-called quantum neural-networks, are predicted to be one of the most important near-term quantum applications, not only because of their similar promises as classical neural-networks, but also…

Programming Languages · Computer Science 2020-04-03 Shaopeng Zhu , Shih-Han Hung , Shouvanik Chakrabarti , Xiaodi Wu

Reservoir simulations are computationally expensive in the well control and well placement optimization. Generally, numerous simulation runs (realizations) are needed in order to achieve the optimal well locations. In this paper, we propose…

Machine Learning · Computer Science 2022-03-23 Haoyu Tang , Wennan Long

Quantum circuit optimization - the process of transforming a quantum circuit into an equivalent one with reduced time and space requirements - is crucial for maximizing the utility of current and near-future quantum devices. While most…

Quantum Physics · Physics 2026-01-23 Marcin Szyniszewski , Aleks Kissinger , Noah Linden , Paul Skrzypczyk

Deep learning is one of the most successful and far-reaching strategies used in machine learning today. However, the scale and utility of neural networks is still greatly limited by the current hardware used to train them. These concerns…

Machine Learning · Computer Science 2022-01-12 Davis Arthur , Prasanna Date

Recent advancements in quantum computing have shown promising computational advantages in many problem areas. As one of those areas with increasing attention, hybrid quantum-classical machine learning systems have demonstrated the…

Neural and Evolutionary Computing · Computer Science 2023-01-18 Li Ding , Lee Spector

Transformers are increasingly employed for graph data, demonstrating competitive performance in diverse tasks. To incorporate graph information into these models, it is essential to enhance node and edge features with positional encodings.…

We present a quantum circuit optimization technique that takes into account the variability in error rates that is inherent across present day noisy quantum computing platforms. This method can be run post qubit routing or post-compilation,…

Quantum Physics · Physics 2023-03-22 Paul D. Nation , Matthew Treinish

Quantum architecture search (QAS) has emerged to automate the design of high-performance quantum circuits under specific tasks and hardware constraints. We propose a noise-aware quantum architecture search (NA-QAS) framework based on…

Quantum Physics · Physics 2026-01-19 Chenlu Li , Hui Zeng , Dazhi Ding

Variational quantum algorithms (VQAs) constitute a prominent framework for exploring the capabilities of near-term quantum computers. As the effectiveness of VQAs depends heavily on the design of variational quantum circuits, Quantum…

Quantum Physics · Physics 2026-04-30 Haozhen Situ , Zhimin He , Lvzhou Li

During the COVID-19 crisis, mechanistic models have guided evidence-based decision making. However, time-critical decisions in a dynamical environment limit the time available to gather supporting evidence. We address this bottleneck by…

Machine Learning · Computer Science 2026-01-15 Agatha Schmidt , Henrik Zunker , Alexander Heinlein , Martin J. Kühn

Variational Quantum Algorithms (VQAs) are a class of hybrid quantum-classical algorithms that leverage on classical optimization tools to find the optimal parameters for a parameterized quantum circuit. One relevant application of VQAs is…

Quantum Physics · Physics 2026-01-26 Mirko Legnini , Julian Berberich

Considering the noise level limit, one crucial aspect for quantum machine learning is to design a high-performing variational quantum circuit architecture with small number of quantum gates. As the classical neural architecture search…

Quantum Physics · Physics 2024-03-08 Jialin Chen , Zhiqiang Cai , Ke Xu , Di Wu , Wei Cao

In recent years, there has been notable interest in investigating combinatorial optimization (CO) problems by neural-based framework. An emerging strategy to tackle these challenging problems involves the adoption of graph neural networks…

Machine Learning · Computer Science 2024-06-11 Yang Liu , Chuan Zhou , Peng Zhang , Shirui Pan , Zhao Li , Hongyang Chen

We present a graph neural network (GNN) based surrogate framework for molecular dynamics simulations that directly predicts atomic displacements and learns the underlying evolution operator of an atomistic system. Unlike conventional…

Materials Science · Physics 2025-12-29 Judah Immanuel , Avik Mahata , Aniruddha Maiti

Combinatorial optimization (CO) problems are crucial in various scientific and industrial applications. Recently, researchers have proposed using unsupervised Graph Neural Networks (GNNs) to address NP-hard combinatorial optimization…

Machine Learning · Computer Science 2024-07-24 Daria Pugacheva , Andrei Ermakov , Igor Lyskov , Ilya Makarov , Yuriy Zotov

Graph Neural Networks (GNNs) have greatly advanced the semi-supervised node classification task on graphs. The majority of existing GNNs are trained in an end-to-end manner that can be viewed as tackling a bi-level optimization problem.…

Machine Learning · Computer Science 2023-07-20 Haoyu Han , Xiaorui Liu , Haitao Mao , MohamadAli Torkamani , Feng Shi , Victor Lee , Jiliang Tang

Parameterized quantum circuits (PQCs) are crucial for quantum machine learning and circuit synthesis, enabling the practical implementation of complex quantum tasks. However, PQC learning has been largely confined to classical optimization…

Quantum Physics · Physics 2024-10-01 Keren Li , Yuanfeng Wang , Pan Gao , Shenggen Zheng

Simulating quantum circuits using classical computers can accelerate the development and validation of quantum algorithms. Our newly developed algorithm, variational quantum search (VQS), has shown an exponential advantage over Grover's…

Quantum Physics · Physics 2023-09-13 Mohammadreza Soltaninia , Junpeng Zhan

Node representation learning by using Graph Neural Networks (GNNs) has been widely explored. However, in recent years, compelling evidence has revealed that GNN-based node representation learning can be substantially deteriorated by…

Machine Learning · Computer Science 2023-12-19 Jun Zhuang , Mohammad Al Hasan
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