AlphaUncommon
liugangcode/torch-molecule
torch-molecule is a deep learning package for molecular discovery, designed with an sklearn-style interface for property prediction, inverse design and representation learning.
- Owner
- liugangcode (personal account)
- Stars
- Stars: 333
- Forks
- Forks: 41
- Language
- Python
- License
- MIT
- Created
- 2024
- Topics
- deep-learninggraph-neural-networksinverse-designmoleculeproperty-predictionrepresentation-learning
- Tier
- Alpha (250 to 699 ★) What this tier means
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