3 papers
cs.LG2026
A Large-Scale Dataset and Benchmark: Do Protein-Ligand Models Learn Binding Sites or Just Binding Likelihood?
Zhaohan Meng, Zhen Bai, Ke Yuan +4
Protein-ligand modeling underpins computational drug discovery and molecular design. Existing protein-ligand benchmarks typically evaluate whether a protein and ligand interact and…
cs.CL2025
GraphMed-LT: Patient-Specific Graph Memory with Latent Clinical Thought Refinement for Multi-Turn Medical Conversations
Zhaohan Meng, Zaiqiao Meng, Siwei Liu +3
Multi-turn medical question answering (QA) aims to model realistic clinical diagnosis, where a doctor gathers patient information across multiple turns of conversation. Existing mu…
q-bio.QM2025
FusionDTI: Fine-grained Binding Discovery with Token-level Fusion for Drug-Target Interaction
Zhaohan Meng, Zaiqiao Meng, Ke Yuan +1
Predicting drug-target interaction (DTI) is critical in the drug discovery process. Despite remarkable advances in recent DTI models through the integration of representations from…