Open skfegan opened 6 years ago
In prepare/amber there are three files (complex.py, ligand.py, and protein.py) which all contain prepare_top and create_top functions. These functions should be merged to avoid duplication and reduce the confusion.
In prepare/amber there are three files (complex.py, ligand.py, and protein.py) which all contain prepare_top and create_top functions. These functions should be merged to avoid duplication and reduce the confusion.