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The Open Molecules 2025 (OMol25) Dataset, Evaluations, and Models

BibTeX

@article{levine2025omol,
  title={The Open Molecules 2025 (OMol25) Dataset, Evaluations, and Models},
  author={Levine*, Daniel S. and Shuaibi*, Muhammed and Spotte-Smith, Evan Walter Clark and Taylor, Michael G. and Hasyim, Muhammad R. and Michel, Kyle and Batatia, Ilyes and Csányi, Gábor and Dzamba, Misko and Eastman, Peter and Frey, Nathan C. and Fu, Xiang and Gharakhanyan, Vahe and Krishnapriyan, Aditi S. and Rackers, Joshua A. and Raja, Sanjeev and Rizvi, Ammar and Rosen, Andrew S. and Ulissi, Zachary and Vargas, Santiago and Zitnick, C. Lawrence and Blau, Samuel M. and Wood, Brandon M.},
  journal={arXiv},
  year={2025},
  doi={10.48550/arXiv.2505.08762}
}

The Open Molecules 2025 (OMol25) Dataset, Evaluations, and Models (2025)
Daniel S. Levine*, Muhammed Shuaibi*, Evan Walter Clark Spotte-Smith, Michael G. Taylor, Muhammad R. Hasyim, Kyle Michel, Ilyes Batatia, Gábor Csányi, Misko Dzamba, Peter Eastman, Nathan C. Frey, Xiang Fu, Vahe Gharakhanyan, Aditi S. Krishnapriyan, Joshua A. Rackers, Sanjeev Raja, Ammar Rizvi, Andrew S. Rosen, Zachary Ulissi, Santiago Vargas, C. Lawrence Zitnick, Samuel M. Blau, Brandon M. Wood
arXiv / preprint / code / bibTeX