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Crystal-GFN: sampling crystals with desirable properties and constraints.

Alex Hernández-GarcíaAlexandre DuvalAlexandra VolokhovaYoshua BengioDivya SharmaPierre Luc CarrierMichal KoziarskiVictor Schmidt
Published in: CoRR (2023)
Keyphrases
  • desirable properties
  • global constraints
  • random sampling
  • constraint satisfaction
  • modal logic