An MCP server for deconstructing and analyzing Metal-Organic Framework (MOF) structures, including SBU and ligand identification, guest removal, and COF stacking analysis. It enables AI agents to perform automated chemical informatics and structural characterization on crystal structures via CIF files.
Enables molecular visualization and analysis from SMILES strings using multiple rendering approaches (RDKit, NetworkX, Plotly, matplotlib), providing detailed molecular properties, validation, and batch processing capabilities for chemical structures.
Enables querying crystallographic data from the Crystallography Open Database (COD) via natural language or direct tool calls, allowing AI agents to retrieve and analyze crystal structure information.
