[gmx-users] Re:writing xtc file from trr file

JMandumpal jesbman at rediffmail.com
Thu Mar 27 09:15:23 CET 2008

>Dear all,

>While running a job, since there was space problem I could not write the xtc files. Now when I do the analysis and use the trr file it reports the >time values after every 5ps i.e. 2000, 2005, 2010 etc. However I wish to >write the xtc file using trjconv such that the timestep is reported >after every picosecond.
>Is this possible or do I need to rerun the entire simulation again to >get the xtc file?


Well, How about trying this command:

trjconv -f *.trr -o *.xtc

Jestin Mandumpal
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