[gmx-users] How to avoid dumping trr file?
chris.neale at mail.utoronto.ca
Fri Nov 9 15:31:44 CET 2012
By dumping, I presume you mean writing it to disk during mdrun.
set this in your .mdp file:
nstxout = 0
nstvout = 0
nstfout = 0
And, while you are at it:
nstlog = 0
-- original message --
Sometimes I do not need to dump the .trr file, which is really big.
I am wondering if I can avoid it?
Thank you very much.
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