"""Load DAVIS kinase binding dataset into NegBioDB. Usage: uv run python scripts/load_davis.py [--skip-api] Prerequisites: - Database created: make db - DAVIS data downloaded: make download-davis """ import argparse import logging from pathlib import Path from negbiodb.db import DEFAULT_DB_PATH from negbiodb.etl_davis import run_davis_etl def main(): parser = argparse.ArgumentParser(description="Load DAVIS into NegBioDB") parser.add_argument( "--db-path", type=Path, default=DEFAULT_DB_PATH, help="Path to NegBioDB SQLite database", ) parser.add_argument( "--skip-api", action="store_true", help="Skip UniProt API mapping, use cached mapping only", ) args = parser.parse_args() logging.basicConfig( level=logging.INFO, format="%(asctime)s %(levelname)s %(message)s", ) print("=== DAVIS ETL ===") stats = run_davis_etl(args.db_path, skip_api=args.skip_api) print(f"\n=== DAVIS ETL Summary ===") print(f"Compounds: {stats['compounds_inserted']} standardized") print(f"Targets: {stats['targets_inserted']} mapped, " f"{stats['targets_unmapped']} unmapped (skipped)") print(f"Results: {stats['results_loaded']} negative results loaded") print(f"Skipped: {stats['results_skipped_unmapped']} unmapped, " f"{stats['results_skipped_active']} active, " f"{stats['results_skipped_borderline']} borderline") print(f"Pairs: {stats['pairs_created']} compound-target pairs") print("\nDAVIS ETL complete.") if __name__ == "__main__": main()