[gmx-users] Problem with trjorder in 3.3.1
zhongqiao_hu at nus.edu.sg
Sat May 20 14:21:41 CEST 2006
I tried to used the program trjorder (in the version 3.3.1) like this:
trjorder -f xtc_4.xtc -s tpr_4.tpr -n index.ndx -o ordered.xtc -b 0 -e
10 -r 0.3
But the program always output nshell.xvg file, without ordered.xtc file.
And I also tried this program in 3.2.1 using the same set of input files
and got the right .xtc output file.
Anyone used this program and give some solution for this? Thank you very
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