[gmx-users] mdrun -x for REMD does not work
jlenz at zbh.uni-hamburg.de
Fri Sep 25 14:27:49 CEST 2009
I doing REMD simulations on a variety of peptides for 5 different
Since the output trr files are very big before the compression I tried
to give the mdrun function the -x option in order to write out
Unfortunately that does not work. There is no xtc file written out.
Instead, there occur the five different traj.trr files.
Is there a chance to directly write out compressed files ? What did I
do wrong ?
Thanks for an answer,
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