PubChem
Accesses PubChem's vast chemical database for comprehensive chemical search, structure analysis, property prediction, bioactivity data, and safety information.
소개
The PubChem server provides a robust Model Context Protocol (MCP) interface to the extensive PubChem chemical database, granting access to over 110 million compounds. It offers a rich suite of chemical informatics tools, including advanced search capabilities by various identifiers and structures, detailed molecular property and descriptor calculations, bioassay and activity data retrieval, and critical safety and toxicity assessments. Designed for seamless integration, this server enhances chemical and biological workflows by enabling complex queries, structural analyses, ADMET predictions, and cross-database interactions, making it an indispensable resource for chemical research and discovery.
주요 기능
- Comprehensive chemical search and retrieval capabilities
- Advanced structure analysis and similarity comparisons
- Extensive chemical properties and molecular descriptors calculation
- Detailed bioassay and biological activity data access
- Critical safety, toxicity, and regulatory information retrieval
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사용 사례
- Integrating with other chemical and biological databases for cross-workflow analysis
- Performing detailed chemical similarity and structural analysis
- Facilitating comprehensive drug discovery workflows
