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cs.LG2026
FuseDiff: Symmetry-Preserving Joint Diffusion for Dual-Target Structure-Based Drug Design
Jianliang Wu, Anjie Qiao, Zhen Wang +2
Dual-target structure-based drug design aims to generate a single ligand together with two pocket-specific binding poses, each compatible with a corresponding target pocket, enabli…
cs.LG2025
ReDiSC: A Reparameterized Masked Diffusion Model for Scalable Node Classification with Structured Predictions
Yule Li, Yifeng Lu, Zhen Wang +3
In recent years, graph neural networks (GNN) have achieved unprecedented successes in node classification tasks. Although GNNs inherently encode specific inductive biases (e.g., ac…