GROMACS version: 2022.3
GROMACS modification: No
One could use gmx energy -f gromacs.edr to get the desired term into a xvg file. However, to use this method, one would need to know that terms that are in the edr file beforehand. Say if one is simulating a box of water and using the script echo Proper-Dih | gmx energy -f gromacs.edr would not go very well.
I wonder if there is a keyword that allow gmx energy to dump all the terms into one xvg file?
Like echo all | gmx energy -f gromacs.edr, will dump all the terms that could be selected into an xvg file for further processing?
Thank you.