GROMACS version: 2020.5
GROMACS modification: No
I am running a simulation with multiple polymer chains in a box of solvated with water. I want to check the radius of gyration of each individual polymer chain.
From what I understand,
gmx gyrate -s md.tpr -f md.xtc works fine when I have a single molecule in my box. However, if I have multiple polymer chains in my box, how do I track the ROG of each chain over time from gromacs? Is there an in-built functionality to do something of this nature?