Rethinking the role of frames for SE(3)-invariant crystal structure modeling

Yusei Ito, Tatsunori Taniai, Ryo Igarashi, Yoshitaka Ushiku, K. Ono
2/12/2026

No official code found. Best implementation: omron-sinicx/crystalframer (21 stars, MIT, last commit 2025-10-16).

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omron-sinicx/crystalframerCommunity66%
MIT

The official code respository for "Rethinking the role of frames for SE(3)-invariant crystal structure modeling" (ICLR 2025)

213Cuda, ShellJan 30, 20251 years agoMIT
graph-neural-networkgraph-neural-networksiclriclr2025machine-learning+6 more

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Cite this paper

@article{ito2026rethinking,
  title  = {Rethinking the role of frames for SE(3)-invariant crystal structure modeling},
  author = {Yusei Ito and Tatsunori Taniai and Ryo Igarashi and Yoshitaka Ushiku and K. Ono},
  year   = {2026},
  url    = {https://api.semanticscholar.org/CorpusID:3113e550e8c0ff0e17d43513a769ef410235a7fe},
  journal = {ICLR 2025 2025}
}

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