3 papers
cs.LG2025
Uncertainty-Aware Metabolic Stability Prediction with Dual-View Contrastive Learning
Peijin Guo, Minghui Li, Hewen Pan +6
Accurate prediction of molecular metabolic stability (MS) is critical for drug research and development but remains challenging due to the complex interplay of molecular interactio…
cs.CR2025
Spa-VLM: Stealthy Poisoning Attacks on RAG-based VLM
Lei Yu, Yechao Zhang, Ziqi Zhou +6
With the rapid development of the Vision-Language Model (VLM), significant progress has been made in Visual Question Answering (VQA) tasks. However, existing VLM often generate ina…
cs.LG2024
ViDTA: Enhanced Drug-Target Affinity Prediction via Virtual Graph Nodes and Attention-based Feature Fusion
Minghui Li, Zikang Guo, Yang Wu +5
Drug-target interaction is fundamental in understanding how drugs affect biological systems, and accurately predicting drug-target affinity (DTA) is vital for drug discovery. Recen…