[gmx-users] How can I record only molecule trajectory ?

[Chih-Ying Lin]

Hi
The command
mdrun  -o   traj.trr  -x  traj.xtc

and then, the two files, traj.trr or traj.xtc will record the
trajectory of all the molecules of the simulated system.


How can I record only molecule trajectory with some command?


Thank you
Lin