Software Development

Torchdrug English

PyTorch-native Graph Neural Network framework for molecules and proteins. Suitable for building custom GNN architectures for drug discovery, protein modeling, or knowledge graph reasoning. Best for custom model development, protein property prediction, and retrosynthesis. If you need pretrained models and diverse feature extractors, use deepchem; if you need benchmark datasets, use pytdc.

Publisher / source
aipoch/medical-research-skills (found on GitHub top repositories)
Upstream record
aipoch/medical-research-skills
Version
Version 1
Published
Publication review
Approved for publication
Content fingerprint
f61461ae5e2ad6803c4e74d7e41dbd250608d1436b7feb015a4b358bfbf04926