https://github.com/c-vandenberg/aizynthfinder-seq2seq-transformer
Research project and literature review focused on integrating SMILES-based retrosynthesis using attention-based encoder-decoder and transformer models into AstraZeneca’s AiZynthFinder retrosynthetic planning tool.
https://github.com/c-vandenberg/aizynthfinder-seq2seq-transformer
astrazeneca chemical-reactions cheminformatics chemistry machine-learning sequence-to-sequence transformer
Last synced: about 1 month ago
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Research project and literature review focused on integrating SMILES-based retrosynthesis using attention-based encoder-decoder and transformer models into AstraZeneca’s AiZynthFinder retrosynthetic planning tool.
- Host: GitHub
- URL: https://github.com/c-vandenberg/aizynthfinder-seq2seq-transformer
- Owner: c-vandenberg
- Created: 2024-08-22T19:40:58.000Z (about 1 year ago)
- Default Branch: master
- Last Pushed: 2025-07-07T16:45:06.000Z (3 months ago)
- Last Synced: 2025-07-07T18:08:28.627Z (3 months ago)
- Topics: astrazeneca, chemical-reactions, cheminformatics, chemistry, machine-learning, sequence-to-sequence, transformer
- Language: Python
- Homepage:
- Size: 175 MB
- Stars: 1
- Watchers: 1
- Forks: 0
- Open Issues: 0
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Metadata Files:
- Readme: README.md