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Title: Nonequilibrium and generalized-ensemble molecular dynamics simulations for amyloid fibril

Journal Article · · AIP Conference Proceedings
DOI:https://doi.org/10.1063/1.4938841· OSTI ID:22499150
 [1]
  1. Research Center for Computational Science, Institute for Molecular Science, Okazaki, Aichi 444-8585 (Japan)

Amyloids are insoluble and misfolded fibrous protein aggregates and associated with more than 20 serious human diseases. We perform all-atom molecular dynamics simulations of amyloid fibril assembly and disassembly.

OSTI ID:
22499150
Journal Information:
AIP Conference Proceedings, Vol. 1702, Issue 1; Conference: ICCMSE 2015: International conference of computational methods in sciences and engineering 2015, Athens (Greece), 20-23 Mar 2015; Other Information: (c) 2015 AIP Publishing LLC; Country of input: International Atomic Energy Agency (IAEA); ISSN 0094-243X
Country of Publication:
United States
Language:
English

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