Wyckoff Transformer: Generation of Symmetric Crystals [ICML 2025]
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Updated
Oct 5, 2026 - Python
Wyckoff Transformer: Generation of Symmetric Crystals [ICML 2025]
This is the official implementation of the FLAGG framework as published in the 2026 JMLR paper "FLAGG: Flexible Autoregressive Graph Generation". The framework is highly customizable to create new combinations of autoregressive graph generative models with existing and yet-to-exist one-shot models.
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