mcp_rdkit

mcp_rdkit
Certified

3.8
research_and_data

The MCP RDKit project integrates the RDKit library with the Model Context Protocol framework to provide advanced chemical informatics tools.

🏠📄

The `mcp_rdkit` project is designed to seamlessly integrate the RDKit library with the Model Context Protocol (MCP) framework, offering a robust suite of tools for chemical informatics. This integration allows users to perform complex chemical computations, visualize molecular structures, and calculate various molecular descriptors. The project is structured to facilitate easy communication with an MCP server, enabling advanced chemical informatics tasks. The main components include a server initialization script, RDKit helper functions, and a setup configuration for easy installation and distribution. The project is suitable for users who require advanced chemical analysis capabilities integrated with MCP technology.

Features

  • Molecular Visualization: Generate images of molecules using RDKit.
  • Descriptor Calculation: Compute molecular descriptors such as molecular weight, logP, and more.
  • MCP Server Integration: Communicate with an MCP server for advanced chemical informatics tasks.

Tools

    Related MCP Servers

    View all research_and_data servers →
    firecrawl-mcp-server

    firecrawl-mcp-server

    5.0

    by mendableai

    Firecrawl MCP Server is a Model Context Protocol server implementation that integrates with Firecrawl for web scraping capabilities.

    browser_automation
    biomcp

    biomcp

    4.9

    by genomoncology

    BioMCP is an open-source toolkit designed to enhance AI assistants with specialized biomedical knowledge by connecting them to authoritative biomedical data sources.

    research_and_data
    Sequential Thinking

    Sequential Thinking

    4.7

    by modelcontextprotocol

    An MCP server implementation that provides a tool for dynamic and reflective problem-solving through a structured thinking process.

    research_and_data
    terraform-mcp-server

    terraform-mcp-server

    4.7

    by hashicorp

    The Terraform MCP Server is a Model Context Protocol server that integrates with Terraform Registry APIs for advanced automation in Infrastructure as Code development.

    cloud_platforms
    arxiv-mcp-server

    arxiv-mcp-server

    4.6

    by blazickjp

    The ArXiv MCP Server provides a bridge between AI assistants and arXiv's research repository through the Model Context Protocol (MCP).

    research_and_data
    sitemcp

    sitemcp

    4.6

    by ryoppippi

    SiteMCP is a tool that fetches an entire site and uses it as a Model Context Protocol (MCP) Server.

    research_and_data
    mcp-server-chart

    mcp-server-chart

    4.5

    by antvis

    A Model Context Protocol server for generating charts using AntV.

    research_and_data
    mcp-compass

    mcp-compass

    4.4

    by liuyoshio

    MCP Compass is a discovery and recommendation service for exploring Model Context Protocol servers using natural language queries.

    research_and_data
    pypsa-mcp

    pypsa-mcp

    4.3

    by cdgaete

    PyPSA MCP is a Model Context Protocol (MCP) server for creating, analyzing, and optimizing energy system models using PyPSA (Python for Power System Analysis).

    research_and_data