## Troubleshooting example Say we run: ```python from fragmenstein import Victor victor = Victor(hits=[hit1, hit2], pdb_block=pdbblock) victor.combine() ``` And it fails at the some step. If the error is cryptic, turning on the logging to DEBUG may help. ```python import logging Victor.enable_stdout(level=logging.DEBUG) ``` If it fails at the `Monster` step, seeing the steps may help. Whereas `Victor` has a `modifications` attribute, this is filled only at the end, when `Monster` finishes. As a result one has to look at the `modifications` attribute of `Monster` (`Dict[str, Chem.Mol]`) or of `Rectifier` (`List[Chem.Mol]`). ```python from IPython.display import display for k in victor.monster.modifications: print(k) mol = Chem.Mol(victor.monster.modifications[k]) AllChem.Compute2DCoords(mol) display(mol) ``` The superscript, nominally the isotope represents the ring size. Or seeing them in 3D: ```python from IPython.display import display import nglview as nv for k in victor.monster.modifications: print(k) display(nv.show_rdkit(victor.monster.modifications[k])) ``` Note that there's no way to disable proximity bonding.