Chemistry, Computational Chemistry, Molecular Dynamics, Gromacs, Programming.
├───amber99.ff ├───amber99sb-ildn.ff ├───amber99sb.ff ├───amberGS.ff ├───charmm27.ff ├───gromos43a1.ff ├───gromos43a2.ff ├───gromos45a3.ff ├───gromos53a5.ff ├───gromos53a6.ff ├───gromos54a7.ff └───oplsaa.ff Once all the files are in place, we need to create a way to access the GROMACS binary and