GNNPCSAFT MCP Server
GNNPCSAFT MCP Server is an implementation of the Model Context Protocol (MCP) for GNNPCSAFT tools. GNNPCSAFT leverages Graph Neural Networks (GNNs) to estimate PC-SAFT pure-component parameters, allowing property predictions such as density and vapor pressure for any molecule or mixture. FeOs is used for PC-SAFT calculations.
Other implementations with GNNPCSAFT:
How to Use
Installation
You need uvx installed.
Starting the Server
uvx --from gnnepcsaft-mcp-server gnnpcsaftmcp
Example: Claude Desktop Configuration
{
"mcpServers": {
"gnnpcsaft": {
"command": "uvx",
"args": ["--from", "gnnepcsaft-mcp-server", "gnnpcsaftmcp"]
}
}
}
License
GNU General Public License v3.0
1 maintainer
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