packmol

Pass

Audited by Gen Agent Trust Hub on Mar 19, 2026

Risk Level: SAFECOMMAND_EXECUTIONEXTERNAL_DOWNLOADS
Full Analysis
  • [SAFE]: The skill provides legitimate scientific tools and documentation for molecular dynamics preparation.
  • [COMMAND_EXECUTION]: The script scripts/solvate_helper.py contains functionality to execute the local packmol binary via subprocess.run. This is an intended feature for automating simulation setup.
  • [EXTERNAL_DOWNLOADS]: Documentation references the official Packmol website and standard installation via pip install packmol. These are well-known and trusted sources for scientific software.
Audit Metadata
Risk Level
SAFE
Analyzed
Mar 19, 2026, 04:03 AM