query_ligand_similarity#
- plinder.core.scores.query_ligand_similarity(*, columns: list[str] | None = None, filters: List[List[FILTER]] | List[FILTER] | None = None) DataFrame | None[source]#
Query the ligand similarity database and return the results.
- Parameters:
- columnslist[str], default=None
the columns to return
- filterslist[tuple[str, str, str | set[str]]]
the filters to apply
- Returns:
- dfpd.DataFrame | None
the protein similarity results