Wei-Ying Ma

11 papers Tsinghua University

• AANet: Virtual Screening under Structural Uncertainty via Alignment and Aggregation
• Accelerating 3D Molecule Generative Models with Trajectory Diagnosis
• CIDD: Collaborative Intelligence for Structure-Based Drug Design Empowered by LLMs
• DAPO: An Open-Source LLM Reinforcement Learning System at Scale
• FIGRDock: Fast Interaction-Guided Regression for Flexible Docking
• MOF-BFN: Metal-Organic Frameworks Structure Prediction via Bayesian Flow Networks
• Manipulating 3D Molecules in a Fixed-Dimensional E(3)-Equivariant Latent Space
• Rationalized All-Atom Protein Design with Unified Multi-Modal Bayesian Flow
• Retro-R1: LLM-based Agentic Retrosynthesis
• ShortListing Model: A Streamlined Simplex Diffusion for Discrete Variable Generation
• Straight-Line Diffusion Model for Efficient 3D Molecular Generation