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Molecular dynamics simulations of membrane proteins under asymmetric ionic concentrations

A computational method is developed to allow molecular dynamics simulations of biomembrane systems under realistic ionic gradients and asymmetric salt concentrations while maintaining the conventional periodic boundary conditions required to minimize finite-size effects in an all-atom explicit solve...

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Podrobná bibliografie
Hlavní autoři: Khalili-Araghi, Fatemeh, Ziervogel, Brigitte, Gumbart, James C., Roux, Benoît
Médium: Artigo
Jazyk:Inglês
Vydáno: The Rockefeller University Press 2013
Témata:
On-line přístup:https://ncbi.nlm.nih.gov/pmc/articles/PMC3787774/
https://ncbi.nlm.nih.gov/pubmed/24081985
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1085/jgp.201311014
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