GROMACS version: 2020.1
GROMACS modification: Yes/No
Here post your question
I need some help, were stucked with this command:
python3 cgenff_charmm2gmx_py3_nx2.py FAD FAD_fix.mol2 FAD.str charmm36-jul2021.ff
Note: sudo apt openbabel and pip install networkx==2.1 are all previously done!
The .str file is generated through CGenFF server…
Thank you in advance