[gmx-users] trjorder does not write trajectory file

Mark Abraham Mark.Abraham at anu.edu.au
Sun Nov 11 15:11:47 CET 2007


Dmytro Kovalskyy wrote:
>> It works fine for me under 3.3.1 - what command line are you issuing?
> trjorder -f traj.xtc -s topol.tpr -o 5A -nshell 5A -r 0.5

Reading the source, both -nshell and -r enforce no trajectory output.

Mark



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