riemanngen / README.md
Xin Chen
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metadata
license: apache-2.0
tags:
  - molecule-generation
  - chemistry
  - smiles
  - drug-discovery

RiemannGen checkpoints

Trained checkpoints for the RiemannGen project: two from-scratch MolMIM-style latent sequence models.

  • atom/final-atom.pt + atom/vocab_new.txt -- plain-SMILES model.
  • fragment/final.pt + fragment/vocab_new.txt -- SAFE-fragment-encoded model, for scaffold growth / local fragment editing.

Licensed under Apache License 2.0 -- free to use, modify, and redistribute.

Citation

If you use these checkpoints or the RiemannGen codebase, please cite:

@misc{riemanngen2026,
  title  = {RiemannGen: latent-space molecule generation with atom and fragment backends},
  author = {XeonChem},
  year   = {2026},
  url    = {https://huggingface.co/XeonChem/riemanngen}
}