backfill_hmdb
Bridges missing HMDB identifiers for entries with other IDs using BridgeDb to maximize HMDB coverage without altering existing assignments.
Instructions
Bridge missing HMDB for every non-excluded entry lacking an accepted HMDB, using its available ids (InChIKey/KEGG/ChEBI/PubChem) via BridgeDb in ONE batched call, then accept.
Reflects the run-2 finding that HMDB rides along with KEGG matching and is under-counted; this maximizes HMDB coverage. Does not touch KEGG assignments or the final_class/origin of KEGG-mapped or exogenous entries (HMDB is added as an extra xref); a structure-only entry that gains HMDB → HMDB-mapped. xenobiotic-excluded entries are skipped.
Input Schema
| Name | Required | Description | Default |
|---|---|---|---|
| db | No | ||
| workdir | Yes |