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crystal structure generation
crystal structure generation
3 papers
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Co-occurring keywords
graph neural network
(3962)
language model
(4599)
materials discovery
(11)
material discovery
(6)
periodic invariance
(3)
text-to-structure generation
(3)
sequence tokenization
(1)
se(3) invariance
(1)
equivariant neural network
(75)
message passing neural network
(37)
Papers
Generative Hierarchical Materials Search
NIPS 2024
Invariant Tokenization of Crystalline Materials for Language Model Enabled Generation
NIPS 2024
Equivariant Message Passing Neural Network for Crystal Material Discovery
AAAI 2023
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