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Diffusion models (DMs) represent state-of-the-art generative models for continuous inputs. DMs work by constructing a Stochastic Differential Equation (SDE) in the input space (ie, position space), and using a neural network to reverse it.…

Machine Learning · Computer Science 2024-05-14 Tianrong Chen , Jiatao Gu , Laurent Dinh , Evangelos A. Theodorou , Joshua Susskind , Shuangfei Zhai

We propose a quantum algorithm to solve systems of nonlinear differential equations. Using a quantum feature map encoding, we define functions as expectation values of parametrized quantum circuits. We use automatic differentiation to…

Quantum Physics · Physics 2021-05-20 Oleksandr Kyriienko , Annie E. Paine , Vincent E. Elfving

Variational Quantum Circuits (VQC) are promising models for quantum machine learning, but standard monolithic architectures face an expressivity--trainability dilemma: small circuits can be under-parameterized, while larger circuits are…

Quantum Physics · Physics 2026-05-12 Howard Su , Chen-Yu Liu , Samuel Yen-Chi Chen , Kuan-Cheng Chen , Huan-Hsin Tseng

The expectation that quantum computation might bring performance advantages in machine learning algorithms motivates the work on the quantum versions of artificial neural networks. In this study, we analyze the learning dynamics of a…

Quantum Physics · Physics 2023-10-17 Ufuk Korkmaz , Deniz Türkpençe

Stochastic simulation models effectively capture complex system dynamics but are often too slow for real-time decision-making. Traditional metamodeling techniques learn relationships between simulator inputs and a single output summary…

Machine Learning · Computer Science 2026-01-21 L. Jeff Hong , Yanxi Hou , Qingkai Zhang , Xiaowei Zhang

Quantum classifiers provide sophisticated embeddings of input data in Hilbert space promising quantum advantage. The advantage stems from quantum feature maps encoding the inputs into quantum states with variational quantum circuits. A…

Quantum Physics · Physics 2021-09-07 Napat Thumwanit , Chayaphol Lortaraprasert , Hiroshi Yano , Rudy Raymond

Graphical models are useful tools for describing structured high-dimensional probability distributions. Development of efficient algorithms for generating unbiased and independent samples from graphical models remains an active research…

Quantum Physics · Physics 2026-04-02 Nico Piatkowski , Christa Zoufal

Conventional generative models for materials discovery are predominantly trained and validated using data from Density Functional Theory (DFT) with approximate exchange-correlation functionals. This creates a fundamental bottleneck: these…

Artificial Intelligence · Computer Science 2026-04-30 Mahule Roy

The fundamental question of how to best simulate quantum systems using conventional computational resources lies at the forefront of condensed matter and quantum computation. It impacts both our understanding of quantum materials and our…

Strongly Correlated Electrons · Physics 2021-09-29 Juan Carrasquilla , Di Luo , Felipe Pérez , Ashley Milsted , Bryan K. Clark , Maksims Volkovs , Leandro Aolita

This study delves into the connection between machine learning and lattice field theory by linking generative diffusion models (DMs) with stochastic quantization, from a stochastic differential equation perspective. We show that DMs can be…

High Energy Physics - Lattice · Physics 2023-11-08 Lingxiao Wang , Gert Aarts , Kai Zhou

The task of deducing three-dimensional molecular configurations from their two-dimensional graph representations holds paramount importance in the fields of computational chemistry and pharmaceutical development. The rapid advancement of…

Biomolecules · Quantitative Biology 2025-01-09 Bobin Yang , Jie Deng , Zhenghan Chen , Ruoxue Wu

Generative modeling is one of the most promising applications of quantum machine learning, yet training and deploying Quantum Generative Models (QGMs) on near-term hardware remains effectively intractable due to prohibitive gradient…

Due to the linearity of quantum mechanics, it remains a challenge to design quantum generative machine learning models that embed non-linear activations into the evolution of the statevector. However, some of the most successful classical…

Quantum Physics · Physics 2023-01-18 Kaitlin Gili , Mykolas Sveistrys , Chris Ballance

While deep generative models (DGMs) have gained popularity, their susceptibility to biases and other inefficiencies that lead to undesirable outcomes remains an issue. With their growing complexity, there is a critical need for early…

Machine Learning · Computer Science 2024-12-18 Vidya Prasad , Anna Vilanova , Nicola Pezzotti

In recent proposals of quantum circuit models for generative tasks, the discussion about their performance has been limited to their ability to reproduce a known target distribution. For example, expressive model families such as Quantum…

Training generative adversarial networks (GAN) in a distributed fashion is a promising technology since it is contributed to training GAN on a massive of data efficiently in real-world applications. However, GAN is known to be difficult to…

Machine Learning · Computer Science 2020-10-27 Xiaojun Chen , Shu Yang , Li Shen , Xuanrong Pang

Generative modeling has seen a rising interest in both classical and quantum machine learning, and it represents a promising candidate to obtain a practical quantum advantage in the near term. In this study, we build over a proposed…

Quantum Physics · Physics 2025-07-31 Mohamed Hibat-Allah , Marta Mauri , Juan Carrasquilla , Alejandro Perdomo-Ortiz

Building large-scale quantum computers, essential to demonstrating quantum advantage, is a key challenge. Quantum Networks (QNs) can help address this challenge by enabling the construction of large, robust, and more capable quantum…

Quantum Physics · Physics 2025-03-20 Xiaojie Fan , Caitao Zhan , Himanshu Gupta , C. R. Ramakrishnan

Beyond their origin in modeling many-body quantum systems, tensor networks have emerged as a promising class of models for solving machine learning problems, notably in unsupervised generative learning. While possessing many desirable…

Machine Learning · Computer Science 2024-07-26 Alex Meiburg , Jing Chen , Jacob Miller , Raphaëlle Tihon , Guillaume Rabusseau , Alejandro Perdomo-Ortiz

Due to the limited qubit number of quantum devices, distributed quantum computing is considered a promising pathway to overcome this constraint. In this paradigm, multiple quantum processors are interconnected to form a cohesive…

Quantum Physics · Physics 2026-03-02 Xia Liu , Jiayi Zhao , Benchi Zhao , Xin Wang