Chemspace

소개

Chemspace is an MCP server designed to empower AI agents with advanced chemical search capabilities. It acts as a wrapper for the Chemspace API, providing a seamless interface for agents to discover synthesizable building blocks and screening compounds. The server supports exact, substructure, and similarity searches, allowing for precise and flexible exploration of chemical databases. Agents can specify various product categories, including in-stock and make-on-demand compounds, and tailor searches to specific shipping countries, making it a powerful tool for chemical discovery and supply chain integration.

주요 기능

• Exact Search for molecular matches by SMILES
• Similarity Search for structurally similar compounds by SMILES
• Specify global shipping countries using ISO codes
• Substructure Search for compounds containing specific substructures
• Search across multiple product categories (in-stock, make-on-demand)
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사용 사례

• Automating the search for chemical building blocks in AI-driven synthesis planning
• Enabling AI agents to identify potential screening compounds for drug discovery
• Integrating chemical compound search capabilities into AI workflows for material science research