[gmx-users] trjconv select group

francesca vitalini francesca.vitalini11 at gmail.com
Fri Feb 3 14:21:37 CET 2012


Hi!
I have to use the gromacs command trjconv to obtain a .gro file from a .xtc
and a .pdb file. I have to do it for several files in a bash for loop so
I'd rather prefer to find a way to make my script type in the trjconv
interactive terminal always the same number for the system. Any tips?
Thanks
Francesca
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