There is mentioned that for re-running an MD run for better statistics, it can
be good to change starting coordinates, besides the seed, is there a gmx
command which is used for randomly change starting coordinates of a pdb file?
I need such a command or script for a PBS script which automatica
Hi,
On Tue, Aug 25, 2015 at 5:08 AM PER HENRY ANDREAS WITTLER <
17526...@students.latrobe.edu.au> wrote:
> There is mentioned that for re-running an MD run for better statistics, it
> can be good to change starting coordinates, besides the seed, is there a
> gmx command which is used for randomly