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Peptide Aggregation and Pore Formation in a Lipid Bilayer: A Combined Coarse-Grained and All Atom Molecular Dynamics Study

We present a simulation study where different resolutions, namely coarse-grained (CG) and all-atom (AA) molecular dynamics simulations, are used sequentially to combine the long timescale reachable by CG simulations with the high resolution of AA simulations, to describe the complete processes of pe...

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Auteurs principaux: Thøgersen, Lea, Schiøtt, Birgit, Vosegaard, Thomas, Nielsen, Niels Chr., Tajkhorshid, Emad
Format: Artigo
Langue:Inglês
Publié: The Biophysical Society 2008
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Accès en ligne:https://ncbi.nlm.nih.gov/pmc/articles/PMC2567951/
https://ncbi.nlm.nih.gov/pubmed/18676652
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1529/biophysj.108.133330
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