[gmx-users] separating bilayers

Xavier Periole Xavier.Periole at physbio.mssm.edu
Wed Feb 5 13:41:47 CET 2003


Hi

in gromacs the origin (0,0,0) is at a corner of the box. So if you 
center your
system (bilayer) on the corner, it reconstructs the box according to this
position and you get what you've gotten.
To avoid that you a have to center your system at 
(box(x)/2,box(y)/2,box(z)/2).

Xavier




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