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"EquiReact: An equivariant neural network for chemical reactions."
Puck van Gerwen et al. (2023)
- Puck van Gerwen, Ksenia R. Briling, Charlotte Bunne, Vignesh Ram Somnath, Rubén Laplaza, Andreas Krause, Clémence Corminboeuf:
EquiReact: An equivariant neural network for chemical reactions. CoRR abs/2312.08307 (2023)
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