Multiscale molecular dynamics simulations of membrane remodeling by Bin/Amphiphysin/Rvs family proteins
Chan Chun1, 2, Wen Haohua1, Lu Lanyuan3, Fan Jun1, 2, †,
       

(a) All-atom MD simulations by Cuiet al.[97]demonstrating symmetrical binding of the N-BAR domain of endophilin protein. Reproduced with permission from Ref. [97]. Copyright by 2009 Biophysical Society. (b) All-atom MD simulations by Panget al.[80]capturing asymmetrical binding of BAR-PH domain protein on PIP2-containing membrane. (c) CG MD simulations done by Yuet al.[58]show the dynamic process of closing of the membrane by an array of F-BAR proteins. Reproduced with permission from Ref. [58]. Copyright 2013 Yu, Schulten. (d) Mesoscopic model developed by Aytonet al.[95]in turn succeeded in showing tubulation and vesiculation. Reproduced with permission from Ref. [95]. Copyright by 2009 Biophysical Society.