Journal of chemical information and modeling
Multi-Modal Fusion Frameworks of Subgraph-Optimized Graph Autoencoder for Molecular Property Prediction.
Kaiyuan Zhang, Congyu Han, Fenghua Zhang, Cheng Lin, Quanlong Li, Tianyi Zang, Yanli Zhao
Published: 202610.1021/acs.jcim.5c02536
Abstract
Molecular property prediction refers to predicting the properties of a given molecular representation. This task is of great significance in fields such as drug design and has garnered widespread attention from researchers. For molecular property pre…
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