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  Efficient generation of random rotation matrices in four dimensions

Bullerjahn, J. T., Fábián, B., & Hummer, G. (2023). Efficient generation of random rotation matrices in four dimensions. Physical Review E, 108(3): 035307. doi:10.1103/PhysRevE.108.035307.

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 Creators:
Bullerjahn, Jakob Tómas1, Author                 
Fábián, Balázs1, Author                 
Hummer, Gerhard1, 2, Author                 
Affiliations:
1Department of Theoretical Biophysics, Max Planck Institute of Biophysics, Max Planck Society, ou_2068292              
2Institute of Biophysics, Goethe University Frankfurt, Frankfurt am Main, Germany, ou_persistent22              

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 Abstract: Four-dimensional (4D) rotations have applications in the fields of robotics, computer vision, and rigid-body mechanics. In the latter, they can be used to transform between equimomental systems of point masses. Here we provide an efficient algorithm to generate random 4D rotation matrices covering an arbitrary, predefined range of rotation angles. These matrices can be combined with Monte Carlo methods for the efficient sampling of the SO(4) group of 4D rotations. The matrices are unbiased and constructed such that repeated rotations result in uniform sampling over SO(4). The algorithm can be used to optimize the mass partitioning in coarse-grained simulation models of molecules involving coupled constraints for stable time integration.

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Language(s): eng - English
 Dates: 2023-05-232023-07-242023-09-192023-09
 Publication Status: Issued
 Pages: 9
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 Table of Contents: -
 Rev. Type: Peer
 Identifiers: DOI: 10.1103/PhysRevE.108.035307
BibTex Citekey: bullerjahn_efficient_2023
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Title: Physical Review E
  Other : Phys. Rev. E
Source Genre: Journal
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Publ. Info: Melville, NY : American Physical Society
Pages: - Volume / Issue: 108 (3) Sequence Number: 035307 Start / End Page: - Identifier: ISSN: 1539-3755
CoNE: https://pure.mpg.de/cone/journals/resource/954925225012