From Coarse Grained to Atomistic: A Serial Multiscale Approach to Membrane Protein Simulations

Coarse-grained molecular dynamics provides a means for simulating the assembly and the interactions of membrane protein/lipid complexes at a reduced level of representation, allowing longer and larger simulations. We describe a fragment-based protocol for converting membrane simulation systems, comp...

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Hlavní autoři: Stansfeld, P, Sansom, M
Médium: Journal article
Jazyk:English
Vydáno: 2011