chemprop
by chempropMessage Passing Neural Networks for Molecule Property Prediction
Official data repository for the Open Reaction Database
This is the project's own description from GitHub — we show it as-is rather than inventing details.
This project is listed under Chemistry in Science & Engineering, a category made for students, researchers, engineers and curious minds.
Do I need coding knowledge? Coding Knowledge Recommended. (Estimate based on project type: A developer tool/library — setup usually follows the README with basic coding skills. Always confirm from the repo's README.)
The source code is released under the CC-BY-SA-4.0 license. Open-source licenses like this usually allow free use, including commercial use — but always read the actual license file in the repository before relying on it. Note: the code being free does not mean hosted services, APIs or infrastructure around it are free.
Activity level: Very active · Last code update: 01 Nov 2026 · Created: 30 Jul 2020 · Open issues: 32
Official links: Official Website ↗ · Releases ↗ · Documentation (README) ↗
We never publish installation steps we have not verified — the README above is the source of truth.
⭐ 350 stars · 🍴 83 forks · 🐛 32 open issues · 💻 Language: Python · 📄 License: CC-BY-SA-4.0 · Default branch: main
Message Passing Neural Networks for Molecule Property Prediction
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