OpenAgentSkill Registry Manifest
Skill: chem-solution-md
Slug: learningmatter-mit-chem-solution-md
Category: [chemistry]
Description: Set up and run molecular dynamics simulations of molecules in explicit solvent boxes using Packmol for box construction and MLIPs for dynamics.

Agent fit:
- Decision: 68/100 Prototype first
- Primary fit: GitHub automation
- Role: Fallback candidate

Supply profile:
- Track: Research and knowledge work
- Scenario: Research agents
- Applicable agents: Claude Code, CLI, Codex, Cursor
- Maintenance: 5d since push
- Risk: Needs review

Trust:
- Trust score: 75/100 Strong shortlist
- Audit: 79/100 Needs review

Attribution:
- Status: Registry indexed
- Source: github candidate review
- Creator: learningmatter-mit
- Claim URL: https://www.openagentskill.com/skills/learningmatter-mit-chem-solution-md#claim-this-skill

Install:
npx skills add learningmatter-mit/AtomisticSkills --skill chem-solution-md

URLs:
- Web: https://www.openagentskill.com/skills/learningmatter-mit-chem-solution-md
- API: https://www.openagentskill.com/api/agent/skills/learningmatter-mit-chem-solution-md
- Install API: https://www.openagentskill.com/api/skills/learningmatter-mit-chem-solution-md/install
- Repository: https://github.com/learningmatter-mit/AtomisticSkills/tree/main/.agents/skills/chem-solution-md