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MCP servers tagged chemistry
9 live MCP servers tagged "chemistry", ranked by trust score. Tags come from package metadata and repository topics, so this list covers servers across every category that work with chemistry.
Chemgraph
Agentic framework for computational chemistry and materials science workflows
Rdkit MCP Server
MCP server that enables language models to interact with RDKit through natural language
Cdk Pywrapper
A Python wrapper for the Chemistry Development Kit (CDK)
Labmate MCP
Your AI lab companion — 78 MCP tools for literature, compounds, synthesis, benchwork, peptides & publication writing
ChemMCP
A Chemistry Toolkit that turns your AI assistant into a Chemistry coscientist..
Pubchem
Production-ready Model Context Protocol server for PubChem chemical data (PUG-REST + PUG-View).
Posebusters MCP Server
Unofficial MCP server for PoseBusters – validate molecular poses via HTTP or Spaces using the Model Context Protocol (MCP).
Mozichem Hub
A modular Python toolkit for creating MCP modules tailored to chemical engineering and chemistry workflows.
laszlopere/mcp-molecules
molecules`.