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Retrosynthesis is the process of recursively decomposing target molecules into available building blocks. It plays an important role in solving problems in organic synthesis planning. To automate or assist in the retrosynthesis analysis,…

Quantitative Methods · Quantitative Biology 2020-11-06 Chaochao Yan , Qianggang Ding , Peilin Zhao , Shuangjia Zheng , Jinyu Yang , Yang Yu , Junzhou Huang

We consider the problem of the variational quantum circuit synthesis into a gate set consisting of the CNOT gate and arbitrary single-qubit (1q) gates with the primary target being the minimization of the CNOT count. First we note that…

Quantum Physics · Physics 2023-05-10 Nikita A. Nemkov , Evgeniy O. Kiktenko , Ilia A. Luchnikov , Aleksey K. Fedorov

Noise characterization methods such as randomized benchmarking (RB) are critical for the development of scalable quantum computers. Modern RB protocols for multiqubit systems extract physically relevant error rates by exploiting the…

Quantum Physics · Physics 2026-04-15 Yale Fan , Riley Murray , Thaddeus D. Ladd , Kevin Young , Robin Blume-Kohout

The work proposes an extension of the quantum circuit formalism where qubits (wires) are circular instead of linear. The left-to-right interpretation of a quantum circuit is replaced by a circular representation which allows to select the…

Quantum Physics · Physics 2016-04-12 Alexandru Paler

As quantum processors grow in scale and reliability, the need for efficient quantum gate decomposition of circuits to a set of specific available gates, becomes ever more critical. The decomposition of a particular algorithm into a sequence…

Quantum Physics · Physics 2025-01-30 Jonathan Nemirovsky , Maya Chuchem , Yotam Shapira

Logic Programming languages and combinational circuit synthesis tools share a common "combinatorial search over logic formulae" background. This paper attempts to reconnect the two fields with a fresh look at Prolog encodings for the…

Logic in Computer Science · Computer Science 2008-12-18 Paul Tarau , Brenda Luderman

A novel parallel hybrid quantum-classical algorithm for the solution of the quantum-chemical ground-state energy problem on gate-based quantum computers is presented. This approach is based on the reduced density-matrix functional theory…

Virtual distillation has been proposed as an error mitigation protocol for estimating the expectation values of observables in quantum algorithms. It proceeds by creating a cyclic permutation of $M$ noisy copies of a quantum state using a…

Quantum Physics · Physics 2024-08-21 Pontus Vikstål , Giulia Ferrini , Shruti Puri

In previous work and motivated by a theoretical discussion on physical realizations, a new quantum gate library (the NCV-v1 library) for electronic design automation of quantum circuits has been proposed. Here, qudits instead of qubits are…

Emerging Technologies · Computer Science 2013-09-06 Zahra Sasanian , Robert Wille , D. Michael Miller

The construction of quantum computers is based on the synthesis of low-cost quantum circuits. The quantum circuit of any Boolean function expressed in a Positive Polarity Reed-Muller $PPRM$ expansion can be synthesized using…

Quantum Physics · Physics 2024-07-09 Taghreed Ahmed , Ahmed Younes , and Islam Elkabani

From a geometric approach, we derive the minimum number of applications needed for an arbitrary Controlled-Unitary gate to construct a universal quantum circuit. A new analytic construction procedure is presented and shown to be either…

Quantum Physics · Physics 2009-11-10 Jun Zhang , Jiri Vala , Shankar Sastry , K. Birgitta Whaley

Cyclic reduction is a method for the solution of (block-)tridiagonal linear systems. In this note we review the method tailored to hermitian positive definite banded linear systems. The reviewed method has the following advantages: It is…

Numerical Analysis · Mathematics 2018-07-03 Martin Neuenhofen

A scalable and programmable quantum computer holds the potential to solve computationally intensive tasks that classical computers cannot accomplish within a reasonable time frame, achieving quantum advantage. However, the vulnerability of…

Quantum Physics · Physics 2025-03-04 Younghun Kim , Martin Sevior , Muhammad Usman

We report optimal and asymptotically optimal reversible circuits composed of NOT, CNOT, and Toffoli (NCT) gates, keeping the count by the subsets of the gate types used. This study fine tunes the circuit complexity figures for the…

Quantum Physics · Physics 2018-07-25 Dmitri Maslov

Current and imminent quantum hardware lacks reliability and applicability due to noise and limited qubit counts. Quantum circuit cutting -- a technique dividing large quantum circuits into smaller subcircuits with sizes appropriate for the…

Quantum Physics · Physics 2022-12-05 Daniel Chen , Betis Baheri , Vipin Chaudhary , Qiang Guan , Ning Xie , Shuai Xu

We develop a simple recursive approach to treat reversible condensation polymerization with cyclization. Based upon a minimum set of balance equations, the law of mass action, Gaussian chain statistics, and the assumption of independent…

Soft Condensed Matter · Physics 2023-02-10 Michael Lang , Kiran Suresh Kumar

We apply numerical optimization and linear algebra algorithms for classical computers to the problem of automatically synthesizing algorithms for quantum computers. Using our framework, we apply several common techniques from these…

Numerical Analysis · Mathematics 2025-09-16 Yuxin Huang , Benjamin E. Grossman-Ponemon , David A. B. Hyde

In recent years, reversible logic has emerged as a promising computing paradigm having its applications in low power computing, quantum computing, nanotechnology, optical computing and DNA computing. The classical set of gates such as AND,…

Hardware Architecture · Computer Science 2007-05-23 Himanshu Thapliyal , M. B Srinivas

Mitigation and calibration schemes are central to maximize the computational reach of today's Noisy Intermediate Scale Quantum (NISQ) hardware, but these schemes are often specialized to exclusively address either coherent or decoherent…

Quantum Physics · Physics 2024-06-19 Arnaud Carignan-Dugas , Shashank Kumar Ranu , Patrick Dreher

A systematic procedure for obtaining defect structures through cyclic deformation chains is introduced and explored in detail. The procedure outlines a set of rules for analytically constructing constraint equations that involve the finite…

High Energy Physics - Theory · Physics 2013-04-09 Alex E. Bernardini , Roldao da Rocha
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