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We have demonstrated a prototypical hybrid classical and quantum computational workflow for the quantification of protein-ligand interactions. The workflow combines the Density Matrix Embedding Theory (DMET) embedding procedure with the…

Quantum machine learning aims to release the prowess of quantum computing to improve machine learning methods. By combining quantum computing methods with classical neural network techniques we aim to foster an increase of performance in…

High Energy Physics - Phenomenology · Physics 2021-03-17 Andrew Blance , Michael Spannowsky

Quantum machine learning algorithms based on parameterized quantum circuits are promising candidates for near-term quantum advantage. Although these algorithms are compatible with the current generation of quantum processors, device noise…

Quantum Physics · Physics 2023-10-11 André Melo , Nathan Earnest-Noble , Francesco Tacchino

Finding efficient decoders for quantum error correcting codes adapted to realistic experimental noise in fault-tolerant devices represents a significant challenge. In this paper we introduce several decoding algorithms complemented by deep…

Quantum Physics · Physics 2018-08-01 Christopher Chamberland , Pooya Ronagh

We introduce a quantum neural network, QNN, that can represent labeled data, classical or quantum, and be trained by supervised learning. The quantum circuit consists of a sequence of parameter dependent unitary transformations which acts…

Quantum Physics · Physics 2018-09-03 Edward Farhi , Hartmut Neven

The steady progress of quantum hardware is motivating the search for novel quantum algorithm optimization strategies for near-term, real-world applications. In this study, we propose a novel feature map optimization strategy for Quantum…

Quantum Physics · Physics 2025-03-31 Roberto Moretti , Andrea Giachero , Voica Radescu , Michele Grossi

Pattern recognition algorithms are commonly employed to simplify the challenging and necessary step of track reconstruction in sub-atomic physics experiments. Aiding in the discrimination of relevant interactions, pattern recognition seeks…

Quantum Physics · Physics 2021-07-14 Gregory Quiroz , Lauren Ice , Andrea Delgado , Travis S. Humble

Quantum Computing and especially Quantum Machine Learning, in a short period of time, has gained a lot of interest through research groups around the world. This can be seen in the increasing number of proposed models for pattern…

Quantum Physics · Physics 2020-12-23 Héctor Iván García Hernández , Raymundo Torres Ruiz , Guo-Hua Sun

Neural networks have achieved impressive breakthroughs in both industry and academia. How to effectively develop neural networks on quantum computing devices is a challenging open problem. Here, we propose a new quantum neural network model…

Quantum Physics · Physics 2023-05-16 Min-Gang Zhou , Zhi-Ping Liu , Hua-Lei Yin , Chen-Long Li , Tong-Kai Xu , Zeng-Bing Chen

Noise dominates every aspect of near-term quantum computers, rendering it exceedingly difficult to carry out even small computations. In this paper we are concerned with the modelling of noise in Noisy Intermediate-Scale Quantum (NISQ)…

Quantum Physics · Physics 2021-12-20 Konstantinos Georgopoulos , Clive Emary , Paolo Zuliani

Quantum machine learning has seen considerable theoretical and practical developments in recent years and has become a promising area for finding real world applications of quantum computers. In pursuit of this goal, here we combine…

Quantum processors may enhance machine learning by mapping high-dimensional data onto quantum systems for processing. Conventional feature maps, for encoding data onto a quantum circuit are currently impractical, as the number of entangling…

Quantum Physics · Physics 2026-03-27 Utkarsh Singh , Jean-Frédéric Laprade , Aaron Z. Goldberg , Khabat Heshami

Quantum kernel methods have been proposed as a promising approach for leveraging near-term quantum computers for supervised learning, yet rigorous benchmarks against strong classical baselines remain scarce. We present a comprehensive…

Quantum Physics · Physics 2026-04-22 Siavash Kakavand , Christoph Strohmeyer , Michael Schlotter

Approximation based on perturbation theory is the foundation for most of the quantitative predictions of quantum mechanics, whether in quantum many-body physics, chemistry, quantum field theory or other domains. Quantum computing provides…

Quantum Physics · Physics 2022-09-29 Jinzhao Sun , Suguru Endo , Huiping Lin , Patrick Hayden , Vlatko Vedral , Xiao Yuan

Quantum computers are special purpose machines that are expected to be particularly useful in simulating strongly correlated chemical systems. The quantum computer excels at treating a moderate number of orbitals within an active space in a…

Quantum signal processing (QSP) is a powerful toolbox for the design of quantum algorithms and can lead to asymptotically optimal computational costs. Its realization on noisy quantum computers without fault tolerance, however, is…

Quantum Physics · Physics 2023-09-28 Yuta Kikuchi , Conor Mc Keever , Luuk Coopmans , Michael Lubasch , Marcello Benedetti

A central problem in biophysics and computational drug design is accurate modeling of biomolecules. The current molecular dynamics simulation methods can answer how a molecule inhibits a cancerous cell signaling pathway, or the role of…

Quantum Physics · Physics 2019-10-31 Anurag Mishra , Alireza Shabani

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

With the rapid progress in quantum hardware and software, the need for verification of quantum systems becomes increasingly crucial. While model checking is a dominant and very successful technique for verifying classical systems, its…

Data Structures and Algorithms · Computer Science 2025-03-07 Xin Hong , Dingchao Gao , Sanjiang Li , Shenggang Ying , Mingsheng Ying

Modeling and simulating the protein folding process overall remains a grand challenge in computational biology. We systematically investigate end-to-end quantum algorithms for simulating various protein dynamics with effects, such as…

Quantum Physics · Physics 2025-04-17 Zhenning Liu , Xiantao Li , Chunhao Wang , Jin-Peng Liu