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maintenanceEnables AI agents to search the Chemspace API for synthesizable building blocks and screening compounds using exact matches, substructure searches, and similarity searches by SMILES strings.
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"author:lukasmki" matching MCP servers:
GET /v1/servers — MCP directory API reference- FlicenseBqualityDmaintenanceProvides computational chemistry tools for LLMs, enabling molecular operations like SMILES processing and geometry manipulation via a modular agent and tool system.9-
- AlicenseNot gradedqualityDmaintenanceAn MCP server for running local LLMs using llama-cpp-python, with built-in tools for generating drug-like molecule SMILES.4MIT