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Hands-On Data Science for Chemists
1. Introduction
2. Preliminaries
3. Machine Learning Models
4. Molecular Property Prediction
5. Molecular Property Optimization
6. Reaction Prediction
7. Retrosynthesis
8. Yield Prediction
9. Reaction optimization
10. LLMs for Chemistry
11. Useful Resources
11.1 Workshops
Contact
Acknowledgement
About others
11. Useful Resources
11. Useful Resources
11.1 Workshops
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