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Related papers: The fundamentals of quantum machine learning

200 papers

The predictive accuracy of Machine Learning (ML) models of molecular properties depends on the choice of the molecular representation. Based on the postulates of quantum mechanics, we introduce a hierarchy of representations which meet…

Chemical Physics · Physics 2016-11-23 Bing Huang , O. Anatole von Lilienfeld

Machine learning algorithms are powerful tools for data driven tasks such as image classification and feature detection, however their vulnerability to adversarial examples - input samples manipulated to fool the algorithm - remains a…

A successful Machine Learning (ML) model implementation requires three main components: training dataset, suitable model architecture and training procedure. Given dataset and task, finding an appropriate model might be challenging. AutoML,…

Quantum Physics · Physics 2025-08-19 Tomasz Rybotycki , Piotr Gawron

The intrinsic probabilistic nature of quantum mechanics invokes endeavors of designing quantum generative learning models (QGLMs). Despite the empirical achievements, the foundations and the potential advantages of QGLMs remain largely…

Quantum Physics · Physics 2022-08-08 Yuxuan Du , Zhuozhuo Tu , Bujiao Wu , Xiao Yuan , Dacheng Tao

Quantum machine learning (QML) leverages the potential from machine learning to explore the subtle patterns in huge datasets of complex nature with quantum advantages. This exponentially reduces the time and resources necessary for…

Materials Science · Physics 2024-05-30 Kurudi V Vedavyasa , Ashok Kumar

Here we will give a perspective on new possible interplays between Machine Learning and Quantum Physics, including also practical cases and applications. We will explore the ways in which machine learning could benefit from new quantum…

Quantum Physics · Physics 2021-08-24 Lorenzo Buffoni , Filippo Caruso

Accurate and efficient prediction of electronic wavefunctions is central to ab initio molecular dynamics (AIMD) and electronic structure theory. However, conventional ab initio methods require self-consistent optimization of electronic…

Chemical Physics · Physics 2025-11-12 Yanxian Tao , Lingyun Wan , Xiongzhi Zeng , Yingdi Jin , Jie Liu , Zhenyu Li , Jinlong Yang

Current quantum systems have significant limitations affecting the processing of large datasets with high dimensionality, typical of high energy physics. In the present paper, feature and data prototype selection techniques were studied to…

High Energy Physics - Phenomenology · Physics 2023-12-18 Miguel Caçador Peixoto , Nuno Filipe Castro , Miguel Crispim Romão , Maria Gabriela Jordão Oliveira , Inês Ochoa

Scientific progress is tightly coupled to the emergence of new research tools. Today, machine learning (ML)-especially deep learning (DL)-has become a transformative instrument for quantum science and technology. Owing to the intrinsic…

Quantum Physics · Physics 2025-08-15 Timothy Heightman , Marcin Płodzień

The core of quantum machine learning is to devise quantum models with good trainability and low generalization error bound than their classical counterparts to ensure better reliability and interpretability. Recent studies confirmed that…

Quantum Physics · Physics 2021-06-10 Yang Qian , Xinbiao Wang , Yuxuan Du , Xingyao Wu , Dacheng Tao

Machine learning (ML) has been leveraged to tackle a diverse range of tasks in almost all branches of nuclear engineering. Many of the successes in ML applications can be attributed to the recent performance breakthroughs in deep learning,…

Systems and Control · Electrical Eng. & Systems 2025-03-25 Xu Wu , Lesego E. Moloko , Pavel M. Bokov , Gregory K. Delipei , Joshua Kaizer , Kostadin N. Ivanov

With near-term quantum devices available and the race for fault-tolerant quantum computers in full swing, researchers became interested in the question of what happens if we replace a supervised machine learning model with a quantum…

Quantum Physics · Physics 2021-04-20 Maria Schuld

Geometric Machine Learning (GML) has shown that respecting non-Euclidean geometry in data spaces can significantly improve performance over naive Euclidean assumptions. In parallel, Quantum Machine Learning (QML) has emerged as a promising…

Quantum computing has garnered significant attention in recent years from both academia and industry due to its potential to achieve a "quantum advantage" over classical computers. The advent of quantum computing introduces new challenges…

Quantum Physics · Physics 2024-08-09 Zhengping Jay Luo , Tyler Stewart , Mourya Narasareddygari , Rui Duan , Shangqing Zhao

Quantum machine learning (QML) is making rapid progress, and QML-based models hold the promise of quantum advantages such as potentially higher expressivity and generalizability than their classical counterparts. Here, we present work on…

Quantum Physics · Physics 2026-01-30 Mierk Schwabe , Lorenzo Pastori , Valentina Sarandrea , Veronika Eyring

Essentials of the scientific discovery process have remained largely unchanged for centuries: systematic human observation of natural phenomena is used to form hypotheses that, when validated through experimentation, are generalized into…

Disordered Systems and Neural Networks · Physics 2019-06-21 Yi Zhang , A. Mesaros , K. Fujita , S. D. Edkins , M. H. Hamidian , K. Ch'ng , H. Eisaki , S. Uchida , J. C. Séamus Davis , E. Khatami , Eun-Ah Kim

Neural networks are computing models that have been leading progress in Machine Learning (ML) and Artificial Intelligence (AI) applications. In parallel, the first small scale quantum computing devices have become available in recent years,…

Quantum Physics · Physics 2021-05-21 Stefano Mangini , Francesco Tacchino , Dario Gerace , Daniele Bajoni , Chiara Macchiavello

Quantum machine learning (QML) has emerged as a promising field that leans on the developments in quantum computing to explore large complex machine learning problems. Recently, some purely quantum machine learning models were proposed such…

Quantum Physics · Physics 2021-06-02 Mahdi Chehimi , Walid Saad

Quantum Key Distribution (QKD) offers theoretically unbreakable security by leveraging quantum mechanics. However, practical implementation is challenged by environmental vulnerabilities, noise, and hardware imperfections. Recently, Machine…

Quantum Physics · Physics 2026-03-10 Ali Al-Kuwari , Safaa Alqrinawi , Lujayn Al-Amir , Amina Mollazehi , Saif Al-Kuwari

Quantum machine learning (QML) networks promise to have some computational (or quantum) advantage for classifying supervised datasets (e.g., satellite images) over some conventional deep learning (DL) techniques due to their expressive…

Quantum Physics · Physics 2023-09-21 Soronzonbold Otgonbaatar , Gottfried Schwarz , Mihai Datcu , Dieter Kranzlmüller