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MCP servers tagged gromacs

3 live MCP servers tagged "gromacs", ranked by trust score. Tags come from package metadata and repository topics, so this list covers servers across every category that work with gromacs.

3
live servers
34
avg trust
1

Novomcp

The open computational chemistry engine for drug discovery and materials science; MCP + REST + Workbench + Next.js dashboard, wrapping RDKit, GROMACS, AutoDock, OpenFold, Chai, Bo…

34
2

Gromacs MCP

GROMACS MCP server for molecular dynamics simulations

34
3

wjgoarxiv/pymol-mcp

wjgoarxiv

bond networks, F3/F4 order parameters, and TRACE cage perception + occupancy.

34
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