LAMMPS
Verified IntegrationClient Configuration
— Connect LAMMPS to Claude Desktop or Cursor in seconds{
"mcpServers": {
"lammps": {
"command": "npx",
"args": [
"-y",
"@modelcontextprotocol/server-lammps"
],
"env": {}
}
}
}~/Library/Application Support/Claude/claude_desktop_config.json (macOS) or %APPDATA%\Claude\claude_desktop_config.json (Windows).System Overview
Enables AI assistants to interact with LAMMPS for molecular dynamics simulations through a standardized interface.
7/23/2026
Open Source
stdio / SSE RPC
Frequently Asked Questions
Architecture and operational details for LAMMPS
The MCP LAMMPS Server is a Model Context Protocol (MCP) server that provides a standardized interface, enabling AI assistants to control LAMMPS (Large-scale Atomic/Molecular Massively Parallel Simulator) for molecular dynamics simulations using natural language commands.
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