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labmate mcp for VS Code

io.github.jonasrackl/labmate-mcp

81 chemistry tools — literature, calculations, retrosynthesis

client:VS Code transport:stdio runtime:pypi

Install labmate mcp in VS Code

.vscode/mcp.json

{
  "inputs": [
    {
      "type": "promptString",
      "id": "rxn-api-key",
      "description": "RXN_API_KEY",
      "password": true
    },
    {
      "type": "promptString",
      "id": "rowan-api-key",
      "description": "ROWAN_API_KEY",
      "password": true
    }
  ],
  "servers": {
    "labmate-mcp": {
      "type": "stdio",
      "command": "uvx",
      "args": [
        "labmate-mcp"
      ],
      "env": {
        "RXN_API_KEY": "${input:rxn-api-key}",
        "ROWAN_API_KEY": "${input:rowan-api-key}"
      }
    }
  }
}

VS Code prompts for each input the first time the server starts, so no secret is written to the file. VS Code docs

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