Closed kienerj closed 2 years ago
From the comment on #24, is this not planned? Or is it something I could help with?
Sorry about that. That was just some GitHub default when marking it as duplicate. I will look into it.
fixed by cdd8d3a68f9b9cc9ede2647691bbe055e45d942d
Converting a very simple molecule (usually salt) with no Bonds but more than 1 Atom from rdkit to cdxml leads to an index error likley caused by line around 299:
This must not be hard coded but actually handle and position the single atoms as well.