Alierkn/gromacs-mcp

MCP server driving local GROMACS workflows for molecular dynamics setup, runs, and analysis.

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gromacs-mcp

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Alierkn/gromacs-mcp

MCP server Claude CodeCodexCursor +2

Model Context Protocol server that drives a local GROMACS installation — build, solvate, ionize, run simulations in the background, and analyse trajectories from any MCP client. Runs locally from the gromacs-mcp Python package.

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