GPU-Accelerated Molecular Dynamics Simulation to Study Liquid Crystal Phase Transition Using Coarse-...
GPU-Accelerated Molecular Dynamics Simulation to Study Liquid Crystal Phase Transition Using Coarse-Grained Gay-Berne Anisotropic Potential
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United States: Public Library of Science
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Language
English
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United States: Public Library of Science
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Gay-Berne (GB) potential is regarded as an accurate model in the simulation of anisotropic particles, especially for liquid crystal (LC) mesogens. However, its computational complexity leads to an extremely time-consuming process for large systems. Here, we developed a GPU-accelerated molecular dynamics (MD) simulation with coarse-grained GB potent...
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Full title
GPU-Accelerated Molecular Dynamics Simulation to Study Liquid Crystal Phase Transition Using Coarse-Grained Gay-Berne Anisotropic Potential
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TN_cdi_plos_journals_1774172661
Permalink
https://devfeature-collection.sl.nsw.gov.au/record/TN_cdi_plos_journals_1774172661
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ISSN
1932-6203
E-ISSN
1932-6203
DOI
10.1371/journal.pone.0151704
