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High-throughput approximations of quantum mechanics calculations and combinatorial experiments have been traditionally used to reduce the search space of possible molecules, drugs and materials. However, the interplay of structural and…

Quantum Physics · Physics 2019-10-29 Alain Tchagang , Julio Valdés

Protein design is a technique to engineer proteins by modifying their sequence to obtain novel functionalities. In this method, amino acids in the sequence are permutated to find the low energy states satisfying the configuration. However,…

Quantitative Methods · Quantitative Biology 2023-05-10 Mohammad Hassan Khatami , Udson C. Mendes , Nathan Wiebe , Philip M. Kim

During the long course of evolution, nature has learnt how to exploit quantum effects. In fact, recent experiments reveal the existence of quantum processes whose coherence extends over unexpectedly long time and space ranges. In…

Quantum Physics · Physics 2015-07-14 G. L. Giorgi , M. Roncaglia , F. A. Raffa , M. Genovese

The extension of thermodynamics into the quantum regime has received much attention in recent years. A primary objective of current research is to find thermodynamic tasks which can be enhanced by quantum mechanical effects. With this goal…

Quantum Physics · Physics 2015-12-10 Mark T. Mitchison , Mischa P. Woods , Javier Prior , Marcus Huber

The parameters of a quantum system grow exponentially with the number of involved quantum particles. Hence, the associated memory requirement goes well beyond the limit of best classic computers for quantum systems composed of a few dozen…

Quantum Physics · Physics 2021-08-31 Jakob S. Kottmann , Mario Krenn , Thi Ha Kyaw , Sumner Alperin-Lea , Alán Aspuru-Guzik

We show that the quantum Zeno effect can be used to suppress the failure events that would otherwise occur in a linear optics approach to quantum computing. From a practical viewpoint, that would allow the implementation of deterministic…

Quantum Physics · Physics 2015-06-26 J. D. Franson , B. C. Jacobs , T. B. Pittman

Irreversible logic is at odds with unitary quantum evolution. Emulating such operations by classical measurements can result in disturbances and high resource demands. To overcome these limitations, we propose protocols that harness…

Quantum Physics · Physics 2022-11-09 E. Zapusek , A. Javadi , F. Reiter

The challenge in building high-fidelity quantum gates lies in overcoming control errors and decoherence effects caused by the coupling between the quantum system and the external environment. Nonadiabatic holonomic quantum computation uses…

Quantum Physics · Physics 2025-11-04 Yue Heng Liu , Qi Li

Computations of chemical systems' equilibrium properties and non-equilibrium dynamics have been suspected of being a "killer app" for quantum computers. This review highlights the recent advancements of quantum algorithms tackling complex…

We investigate fully self-consistent multiscale quantum-classical algorithms on current generation superconducting quantum computers, in a unified approach to tackle the correlated electronic structure of large systems in both quantum…

This article considers the generative modeling of the (mixed) states of quantum systems, and an approach based on denoising diffusion model is proposed. The key contribution is an algorithmic innovation that respects the physical nature of…

Quantum Physics · Physics 2024-05-28 Yuchen Zhu , Tianrong Chen , Evangelos A. Theodorou , Xie Chen , Molei Tao

We present a hybrid model of the unitary-evolution-based quantum computation model and the measurement-based quantum computation model. In the hybrid model part of a quantum circuit is simulated by unitary evolution and the rest by…

Quantum Physics · Physics 2011-05-19 Arun Sehrawat , Daniel Zemann , Berthold-Georg Englert

A low-latency and energy-efficient tensor algebra accelerator design must optimize how data movement and operations are scheduled (i.e., mapped) in the accelerator architecture. A key mapping optimization is fusion, meaning holding data…

Hardware Architecture · Computer Science 2026-05-05 Tanner Andrulis , Michael Gilbert , Vivienne Sze , Joel S. Emer

This work introduces an approach rooted in quantum thermodynamics to enhance sampling efficiency in quantum machine learning (QML). We propose conceptualizing quantum supervised learning as a thermodynamic cooling process. Building on this…

Quantum Physics · Physics 2025-01-07 Nayeli A. Rodríguez-Briones , Daniel K. Park

Computation, if treated as a set of physical processes that act on information represented by states of matter, encompasses biological systems, digital systems, and other constructs, and may be a fundamental measure of living systems. The…

Earth and Planetary Astrophysics · Physics 2024-07-09 Caleb Scharf , Olaf Witkowski

The genetic blueprint for the essential functions of life is encoded in DNA, which is translated into proteins -- the engines driving most of our metabolic processes. Recent advancements in genome sequencing have unveiled a vast diversity…

Neural and Evolutionary Computing · Computer Science 2024-06-12 James S. L. Browning , Daniel R. Tauritz , John Beckmann

We review recent theoretical calculations of quantum entanglement in photosynthetic light harvesting complexes. These works establish, for the first time, a manifestation of this characteristically quantum mechanical phenomenon in…

Quantum Physics · Physics 2010-12-21 K. Birgitta Whaley , Mohan Sarovar , Akihito Ishizaki

We present a number of quantum computing patterns that build on top of fundamental algorithms, that can be applied to solving concrete, NP-hard problems. In particular, we introduce the concept of a quantum dictionary as a summation of…

A quantum computer directly manipulates information stored in the state of quantum mechanical systems. The available operations have many attractive features but also underly severe restrictions, which complicate the design of quantum…

Quantum Physics · Physics 2015-06-26 Sos S. Agaian , Andreas Klappenecker

Current gate-based quantum computers have the potential to provide a computational advantage if algorithms use quantum hardware efficiently. To make combinatorial optimization more efficient, we introduce the Filtering Variational Quantum…