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https://github.com/minkaixu/confvae-icml21
An End-to-End Framework for Molecular Conformation Generation via Bilevel Programming (ICML'21)
https://github.com/minkaixu/confvae-icml21
bilevel-optimization computational-biology computational-chemistry conformation generative-models graph-neural-networks icml-2021 molecule pytorch vae
Last synced: 2 months ago
JSON representation
An End-to-End Framework for Molecular Conformation Generation via Bilevel Programming (ICML'21)
- Host: GitHub
- URL: https://github.com/minkaixu/confvae-icml21
- Owner: MinkaiXu
- Created: 2021-05-28T09:41:46.000Z (over 3 years ago)
- Default Branch: main
- Last Pushed: 2021-08-03T14:17:42.000Z (over 3 years ago)
- Last Synced: 2024-09-22T13:32:42.119Z (3 months ago)
- Topics: bilevel-optimization, computational-biology, computational-chemistry, conformation, generative-models, graph-neural-networks, icml-2021, molecule, pytorch, vae
- Language: Python
- Homepage:
- Size: 381 KB
- Stars: 51
- Watchers: 3
- Forks: 17
- Open Issues: 1