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Deal with residue features in protein-ligand graphs

Open DaniBodor opened this issue 1 year ago • 0 comments

If not all chains contain residue atoms, then some features will not parse properly.

For each such feature decide and implement one of the following:

  • Do not allow the feature in these graph types.
  • Only add the feature to the residue-containing chain and find a proper entry type in the non-residue chain (e.g., nan or 0).

Blocked by #544

DaniBodor avatar Jan 15 '24 11:01 DaniBodor