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In this work, we present the first implementation of the face-centered cubic (FCC) lattice model for protein structure prediction with a quantum algorithm. Our motivation to encode the FCC lattice stems from our observation that the FCC…

Realistic 3D-conformations of protein structures can be embedded in a cubic lattice using exclusively integer numbers, additions, subtractions and boolean operations.

Biological Physics · Physics 2010-04-13 Jacques Gabarro-Arpa

We suggest that a certain one-to-one parametrization of completely positive maps on the matrix algebra might be useful in the study of quantum channels. This is illustrated in the case of binary quantum channels. While the algorithm is…

Operator Algebras · Mathematics 2007-05-23 T. Constantinescu

In this article we introduce theory and algorithms for learning discrete representations that take on a lattice that is embedded in an Euclidean space. Lattice representations possess an interesting combination of properties: a) they can be…

Machine Learning · Computer Science 2020-06-25 Luis A. Lastras

We propose a scheme for quantum computation in optical lattices. The qubits are encoded in the spacial wavefunction of the atoms such that spin decoherence does not influence the computation. Quantum operations are steered by shaking the…

Quantum Gases · Physics 2012-05-22 Philipp-Immanuel Schneider , Alejandro Saenz

Gate-based universal quantum computers form a rapidly evolving field of quantum computing hardware technology. In previous work, we presented a quantum algorithm for lattice protein folding on a cubic lattice, tailored for quantum…

Quantum Physics · Physics 2018-11-01 Mark Fingerhuth , Tomáš Babej , Christopher Ing

We use classes of Hilbert lattice equations for an alternative representation of Hilbert lattices and Hilbert spaces of arbitrary quantum systems that might enable a direct introduction of the states of the systems into quantum computers.…

Quantum Physics · Physics 2008-12-17 Mladen Pavicic , Norman D. Megill

Various aspects of the theory of quantum integrable systems are reviewed. Basic ideas behind the construction of integrable ultralocal and nonultralocal quantum models are explored by exploiting the underlying algebraic structures related…

High Energy Physics - Theory · Physics 2016-09-06 Anjan Kundu

Let C be the set of all possible quantum states. We study the convex subsets of C with attention focused on the lattice theoretical structure of these convex subsets and, as a result, find a framework capable of unifying several aspects of…

Quantum Physics · Physics 2015-06-03 Federico Holik , César Massri , Leandro Zuberman , Angel Plastino

Three-dimensional lattices are fundamental to solid-state physics. The description of a lattice with an atomic basis constitutes the necessary information to predict solid phase properties and evolution. Here, we present a new algorithm for…

Materials Science · Physics 2022-08-17 David Mrdjenovich , Kristin Persson

Quantum machine learning (QML) has great potential for the analysis of chemical datasets. However, conventional quantum data-encoding schemes, such as fingerprint encoding, are generally unfeasible for the accurate representation of…

Quantum Physics · Physics 2025-11-18 Choy Boy , Edoardo Altamura , Dilhan Manawadu , Ivano Tavernelli , Stefano Mensa , David J. Wales

Particle physics underpins our understanding of the world at a fundamental level by describing the interplay of matter and forces through gauge theories. Yet, despite their unmatched success, the intrinsic quantum mechanical nature of gauge…

Quantum computers hold promise to improve the efficiency of quantum simulations of materials and to enable the investigation of systems and properties more complex than tractable at present on classical architectures. Here, we discuss…

Quantum Physics · Physics 2022-05-03 Christian Vorwerk , Nan Sheng , Marco Govoni , Benchen Huang , Giulia Galli

Accurately predicting protein structures from amino acid sequences remains a fundamental challenge in computational biology, with profound implications for understanding biological functions and enabling structure-based drug discovery.…

In this work we discuss logical structures related to indistinguishable particles. Most of the framework used to develop these structures was presented in [17, 28] and in [20, 14, 15, 16]. We use these structures and constructions to…

Quantum Physics · Physics 2013-05-23 Federico Holik , Decio Krause , Ignacio Gómez

We explore the potential application of quantum annealing to address the protein structure problem. To this end, we compare several proposed ab initio protein folding models for quantum computers and analyze their scaling and performance…

Quantum Physics · Physics 2026-04-27 Timon Scheiber , Matthias Heller , Andreas Giebel

Lattice Gas Automata (LGA) is a classical method for simulating physical phenomena, including Computational Fluid Dynamics (CFD). Quantum LGA (QLGA) is the family of methods that implement LGA schemes on quantum computers. In recent years,…

Quantum Physics · Physics 2025-12-23 Călin A. Georgescu , Merel A. Schalkers , Matthias Möller

We present an algorithm to simulate two-dimensional quantum lattice systems in the thermodynamic limit. Our approach builds on the {\em projected entangled-pair state} algorithm for finite lattice systems [F. Verstraete and J.I. Cirac,…

Strongly Correlated Electrons · Physics 2009-11-13 J. Jordan , R. Orus , G. Vidal , F. Verstraete , J. I. Cirac

While quantum computers are capable of simulating many quantum systems efficiently, the simulation algorithms must begin with the preparation of an appropriate initial state. We present a method for generating physically relevant quantum…

Quantum Physics · Physics 2009-05-29 Nicholas J. Ward , Ivan Kassal , Alán Aspuru-Guzik

Predicting protein secondary structure using lattice model is one of the most studied computational problem in bioinformatics. Here secondary structure or three dimensional structure of protein is predicted from its amino acid sequence.…

Computational Engineering, Finance, and Science · Computer Science 2014-07-18 Dipan Lal Shaw , M. Sohel Rahman , A. S. M. Sohidull Islam , Shuvasish Karmaker
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