Search Results for author: Hewen Pan

Found 3 papers, 1 papers with code

Uncertainty-Aware Metabolic Stability Prediction with Dual-View Contrastive Learning

no code implementations1 Jun 2025 Peijin Guo, Minghui Li, Hewen Pan, Bowen Chen, Yang Wu, Zikang Guo, Leo Yu Zhang, Shengshan Hu, Shengqing Hu

Despite recent advances in graph neural networks (GNNs) for MS prediction, current approaches face two critical limitations: (1) incomplete molecular modeling due to atom-centric message-passing mechanisms that disregard bond-level topological features, and (2) prediction frameworks that lack reliable uncertainty quantification.

Contrastive Learning Prediction +1

Multi-Modality Representation Learning for Antibody-Antigen Interactions Prediction

1 code implementation22 Mar 2025 Peijin Guo, Minghui Li, Hewen Pan, Ruixiang Huang, Lulu Xue, Shengqing Hu, Zikang Guo, Wei Wan, Shengshan Hu

While deep learning models play a crucial role in predicting antibody-antigen interactions (AAI), the scarcity of publicly available sequence-structure pairings constrains their generalization.

Graph Attention Prediction +1

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