Dual Resolution Membrane Simulations Using Virtual Sites

[Image: see text] All-atomistic (AA) and coarse-grain (CG) simulations have been successfully applied to investigate a broad range of biomolecular processes. However, the accessible time and length scales of AA simulation are limited and the specific molecular details of CG simulation are simplified...

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Publicat a:J Phys Chem B
Autors principals: Liu, Yang, De Vries, Alex H., Barnoud, Jonathan, Pezeshkian, Weria, Melcr, Josef, Marrink, Siewert J.
Format: Artigo
Idioma:Inglês
Publicat: American Chemical Society 2020
Accés en línia:https://ncbi.nlm.nih.gov/pmc/articles/PMC7232679/
https://ncbi.nlm.nih.gov/pubmed/32314586
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.jpcb.0c01842
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