gmx_mmpbsa is separate from GROMACS. That is almost certainly the reason why no-one has been able to answer your question here. I would advice you to contact the gmx_mmpbsa users/developers.
gmx_mmpbsa is separate from GROMACS. That is almost certainly the reason why no-one has been able to answer your question here. I would advice you to contact the gmx_mmpbsa users/developers.