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• Do Deep Learning Models Really Outperform Traditional Approaches in Molecular Docking?
  2023 · 22 citations
• End-to-End Crystal Structure Prediction from Powder X-Ray Diffraction
  2024 · 6 citations
• Highly Accurate Quantum Chemical Property Prediction with Uni-Mol+
  2023 · 6 citations
• Beyond Atoms: Enhancing Molecular Pretrained Representations with 3D Space Modeling
  2025 · 3 citations
• 3D Molecular Generation via Virtual Dynamics
  2023 · 2 citations
• Unified Cross-Scale 3D Generation and Understanding via Autoregressive Modeling
  2025 · 1 citations
• AREX: Towards a Recursively Self-Improving Agent for Deep Research
  2026
• AgentFactory: A Self-Evolving Framework Through Executable Subagent Accumulation and Reuse
  2026
• pUniFind: a unified large pre-trained deep learning model pushing the limit of mass spectra interpretation
  2025
• Uni-3DAR: Unified 3D Generation and Understanding via Autoregression on Compressed Spatial Tokens
  2025
• General Agentic Memory Via Deep Research
  2025
• Pre-Training Protein Bi-level Representation Through Span Mask Strategy On 3D Protein Chains
  2024