GNNePCSAFT MCP
Type: server
Author: wildsonbbl
Language: Python
Description: This is the Model Context Protocol (MCP) server implementation for GNNePCSAFT tools. GNNePCSAFT is a Graph Neural Network (GNN) that can estimate ePC-SAFT parameters. This allows thermodynamic calculations like density and vapor pressure without experimental data for any molecule. FeOS is used for the PC-SAFT calculations.


Tools:
Server command: uvx --from gnnepcsaft-mcp-server gnnepcsaftmcp
Server configuration:
{
  "mcpServers": {
    "gnnepcsaft": {
      "command": "uvx",
      "args": ["--from", "gnnepcsaft-mcp-server", "gnnepcsaftmcp"]
    }
  }
}