gromacs-mcp mcp_server
Enables running GROMACS molecular dynamics simulations through natural language, with tools for topology building, solvation, simulation management, and trajectory processing via the Model Context Protocol.
- Link
- https://github.com/Alierkn/gromacs-mcp
Listing data from Glama (https://glama.ai) — Glama listing
Adoption
- Maintainer
- alierkn
- Repository
- alierkn/gromacs-mcp
- GitHub stars
- 3
- Last push
- 2026-07-08
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