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GPU-accelerated MCP server for molecular dynamics, N-body simulations, and particle systems
npx @getmcp/cli add io.github.andylbrummer/molecular-mcpRequires Python 3.10+. Community-contributed server. Review source before installing.
Config file: ~/Library/Application Support/Claude/claude_desktop_config.json
{
"mcpServers": {
"io.github.andylbrummer/molecular-mcp": {
"command": "uvx",
"args": [
"scicomp-molecular-mcp"
]
}
}
}