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Reinforcement learning steers generative crystal design
Z
L
DOI:10.1038/s42256-026-01282-0.png)
Abstract
En 中文
Generative machine learning methods have led to progress in crystal discovery, but cannot fully explore the space of material candidates that are both novel and useful. A reinforcement learning-based method steers candidate generation to these areas, enabling the design of novel functional materials.
Journal
IF:
23.9
Papers:
1.3K
Citations:
1.5W
