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Despite rapid recent progress towards the development of quantum computers capable of providing computational advantages over classical computers, it seems likely that such computers will, initially at least, be required to run in a hybrid…

Data Structures and Algorithms · Computer Science 2020-01-27 Alastair A. Abbott , Cristian S. Calude , Michael J. Dinneen , Richard Hua

Quantum computation is a novel way of information processing which allows, for certain classes of problems, exponential speedups over classical computation. Various models of quantum computation exist, such as the adiabatic, circuit and…

Quantum Physics · Physics 2012-08-02 Robert Raussendorf , Tzu-Chieh Wei

The great promise of quantum computers comes with the dual challenges of building them and finding their useful applications. We argue that these two challenges should be considered together, by co-designing full-stack quantum computer…

Artificial intelligence (AI) has sparked immense interest in drug discovery, but most current approaches only digitize existing high-throughput experiments. They remain constrained by conventional pipelines. As a result, they do not address…

Computers and Society · Computer Science 2025-07-29 You Wu , Philip E. Bourne , Lei Xie

Quantum computing is changing the way we think about computing. Significant strides in research and development for managing and harnessing the power of quantum systems has been made in recent years, demonstrating the potential for…

Quantum Physics · Physics 2022-11-15 Suryansh Upadhyay , Mahabubul Alam , Swaroop Ghosh

In silico de novo design can drastically cut the costs and time of drug development. In particular, a key advantage of bottom-up physics-based approaches is their independence from training datasets, unlike generative models. However, they…

Quantum Physics · Physics 2025-12-01 Lars Meuser , Alexandros Patsilinakos , Pietro Faccioli

Quantum computers hold promise to enable efficient simulations of the properties of molecules and materials; however, at present they only permit ab initio calculations of a few atoms, due to a limited number of qubits. In order to harness…

Materials Science · Physics 2020-07-07 He Ma , Marco Govoni , Giulia Galli

Transport engineering has significant potential to benefit from quantum computing. The rise of intelligent transport systems, autonomous vehicles, and the Internet of Things has created an unprecedented demand for efficient information…

Quantum Physics · Physics 2026-03-13 Lachlan Oberg , Paul Corry , Moji Ghadimi , Ashish Bhaskar

In the quest to reboot computing, quantum annealing (QA) is an interesting candidate for a new capability. While it has not demonstrated an advantage over classical computing on a real-world application, many important regions of the QA…

There has been no lack of coverage in the past few years in scientific journals of the topic of quantum computation. Rightly so, as this is a novel idea with--so far--at least one very important practical application (prime factorisation)…

Quantum Physics · Physics 2007-05-23 W. L. Fouché , J. Heidema , P. H. Potgieter

Numerous reports claim that quantum advantage, which should emerge as a direct consequence of the advent of quantum computers, will herald a new era of chemical research because it will enable scientists to perform the kinds of quantum…

Quantum Physics · Physics 2020-09-29 V. E. Elfving , B. W. Broer , M. Webber , J. Gavartin , M. D. Halls , K. P. Lorton , A. Bochevarov

The connection and eventual integration of High-Performance Computing (HPC) with Quantum Computing (QC) represents a transformative advancement in computational technology, promising significant enhancements in solving complex, previously…

Fundamental questions in chemistry and physics may never be answered due to the exponential complexity of the underlying quantum phenomena. A desire to overcome this challenge has sparked a new industry of quantum technologies with the…

Quantum computing has gained a lot of attention recently, and scientists have seen potential applications in this field using quantum computing for Cryptography and Communication to Machine Learning and Healthcare. Protein folding has been…

Quantum Physics · Physics 2022-11-16 Hasan Mustafa , Sai Nandan Morapakula , Prateek Jain , Srinjoy Ganguly

Quantum computing offers the promise of speedups for scientific computations, but its application to reacting flows is hindered by nonlinear source terms, the challenges of time-dependent simulations, and the difficulty of extracting…

Quantum Physics · Physics 2026-03-17 Jizhi Zhang , Ziang Yang , Zhaoyuan Meng , Zhen Lu , Yue Yang

Great progress has been made in quantum computing in recent years, providing opportunities to overcome computation resource poverty in many scientific computations like computational fluid dynamics (CFD). In this work, efforts are made to…

Computational Physics · Physics 2025-07-29 Chuang-Chao Ye , Ning-Bo An , Teng-Yang Ma , Meng-Han Dou , Wen Bai , Zhao-Yun Chen , Guo-Ping Guo

Drug discovery has become a main challenge in our society, following the Covid-19 pandemic. Even pharmaceutical companies are already using computing to accelerate drug discovery. They are increasingly interested in Quantum Computing with a…

Quantum Physics · Physics 2024-02-16 Anthony Chagneau , Yousra Massaoudi , Imene Derbali , Linda Yahiaoui

Quantum computational chemistry has emerged as an important application of quantum computing. Hybrid quantum-classical computing methods, such as variational quantum eigensolvers (VQE), have been designed as promising solutions to quantum…

Quantum computing is a rapidly emerging and promising field that has the potential to revolutionize numerous research domains, including drug design, network technologies and sustainable energy. Due to the inherent complexity and divergence…

De novo drug design with desired biological activities is crucial for developing novel therapeutics for patients. The drug development process is time and resource-consuming, and it has a low probability of success. Recent advances in…

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