[gmx-users] Limiting amount of data Gromacs prints out

Jackson Chief Elk jchiefelk at gmail.com
Sun Aug 10 02:05:06 CEST 2014


Hi,
Gromacs is printing out WAYY more data then there is available on my small cluster at UCSC.  I just need position data from each simulation time step for the analysis I want to perform.  Is there a way that does not involve hacking the source code to set mdrun to print out ONLY the *.xtc file?

Cheers,
Jackson


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