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2025 ICML ICML 2025

Learning Condensed Graph via Differentiable Atom Mapping for Reaction Yield Prediction

Abstract

No abstract available. No abstract was captured for this paper when its proceedings were scraped - most often an older edition published without one online. How the corpus is built.

🌉 Interdisciplinary Bridge - Artificial Intelligence and Knowledge & Reasoning

Authors

Ankit Ghosh, Gargee Kashyap, Sarthak Mittal, Nupur Jain, Raghavan B Sunoj, Abir De

Topics

Machine Learning > Core Methods > Regression Machine Learning > Optimization & Theory > Neural Network Optimization Knowledge & Reasoning > Representation > Knowledge Graphs

Keywords

yield prediction activation barrier atom mapping condensed graph of reaction (cgr) differentiable node alignment network transformer-guided reaction path encoder
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