GROMACS version: 2019
Hi gromacs users,
I did md simulation of chitosan (polymer) - drug. I need to do Flory–Huggins interaction parameter. Can this analysis be done with Gromacs tools? If not, how to convert gromacs trajectory to lammps?
Best,
GROMACS version: 2019
Hi gromacs users,
I did md simulation of chitosan (polymer) - drug. I need to do Flory–Huggins interaction parameter. Can this analysis be done with Gromacs tools? If not, how to convert gromacs trajectory to lammps?
Best,