Documentation
NovoMCP is the computational chemistry engine — 122M pre-computed molecules and 69 in-silico tools across ADMET, FAVES compliance, docking, MD, FEP, and QM. These docs cover every surface that reaches it: your AI assistant, your own code, the desktop, your browser, and your editor. Each is a door into the same engine — one account, one credit balance, one audit trail. Pick where you work.
Chat
Add Novo as a custom connector in Claude, ChatGPT, Gemini, Cursor, and 15+ MCP clients. One URL, OAuth or an API key, and your assistant gains all 69 tools — run the full discovery funnel in chat.
Code
Call any tool from your own code as POST /v1/tools/{name} with a Bearer key. The full catalog is the live OpenAPI 3.1 spec — bring your own model and wire the tools into your own agent loop.
Desktop
A native, auto-updating Mac/Windows workstation for sustained sessions — molecule canvas, 3D viewers, Ghost Molecule, batch analysis, and long-running compute without living inside a chat window.
Browser
Hover any SMILES on PubChem, ChEMBL, or preprints for instant ADMET, FAVES compliance, and similarity search. A side panel carries the molecule into any MCP-connected assistant with "Continue in AI."
Editor
Profile and screen SMILES anywhere you write — manuscripts, protocols, grants — without leaving Word. Inline profile cards in the task pane; ADMET + FAVES results inserted as formatted tables.
Account
app.novomcp.com — where every surface authenticates. Sign up, mint and revoke API keys, track credit usage and billing, and monitor long-running MD/FEP jobs with email notifications.
Want the full tour — how the surfaces share one account, plus the hostname reference? Ways to use Novo →