summarize_docking
Parse Glide pose-viewer files to extract ranked GlideScores and key terms for each ligand, returning the best poses sorted by score.
Instructions
Parse a Glide pose-viewer file (*_pv.maegz) into a ranked table of GlideScores and key terms per ligand. Returns the best poses sorted by score (lower is better).
Input Schema
| Name | Required | Description | Default |
|---|---|---|---|
| pose_file | Yes | ||
| top_n | No |