molecular-mcp
About
GPU-accelerated MCP server for molecular dynamics, N-body simulations, and particle systems
Use this server
Add it to your MCP client. The catalogue lists this config verbatim from its source — it does not run, download, or vouch for the server. Review the command before you run it.
Transportstdio (runs a local command)
Claude Code
claude mcp add molecular-mcp -- uvx scicomp-molecular-mcp
Cursor
If the button doesn't open Cursor, use the JSON below — Cursor accepts the same mcpServers config.
VS Code
code --add-mcp '{"name":"molecular-mcp","command":"uvx","args":["scicomp-molecular-mcp"]}'
JSON
{
"mcpServers": {
"molecular-mcp": {
"command": "uvx",
"args": [
"scicomp-molecular-mcp"
]
}
}
}