GROMACS version: 2020
GROMACS modification: No
I would like to separate a trajectory into separate gro files with coordinates and forces (instead of velocities) - alternatively just writing a gro-like file of forces only, i.e.:
Number Atomname/type … x_force y_force z_force
Am I right that the gro format does not accept forces to be written and I would have to use gmx traj to write the forces that I am interested in? With that output from gmx traj I would have to reformat the forces into something that looks like described above?
Thanks in advance for any advice.