[gmx-users] problem with npt

Mark Abraham Mark.Abraham at anu.edu.au
Fri Dec 14 20:03:27 CET 2007


pragya chohan wrote:
> 
> thanks for your help.
> My system ran fine for 250 ps but later the bilayer deformed very much.

What was your system preparation protocol - i.e. minimization and 
equilibration? See 
http://wiki.gromacs.org/index.php/Steps_to_Perform_a_Simulation

Mark



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