arXiv cs.AI
Mechanistic Reaction Prediction via Discrete Flow Matching on Graph-Structured Electron Occupation
그래프 구조 전자 점유에 대한 이산 흐름 매칭을 통한 메커니즘 반응 예측
No write-up yet — this entry is still just the auto-fetched hook. Aaron's own summary (200–500 words) will replace this note once he's written it.