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• RetroGraph: Retrosynthetic Planning with Graph Search
  2022 · 46 citations
• UniGenX: a unified generative foundation model that couples sequence, structure and function to accelerate scientific design across proteins, molecules and materials
  2025 · 5 citations
• Exploiting Pre-trained Models for Drug Target Affinity Prediction with Nearest Neighbors
  2024 · 3 citations
• Phenotype-Guided In Silico Molecular Generation Using Large Language Models
  2026 · 1 citations
• ForeSci: Evaluating LLM Agents for Forward-Looking AI Research Judgment
  2026
• Deciphering Scientific Reasoning Steps from Outcome Data for Molecule Optimization
  2026
• Trust Region Preference Approximation: A simple and stable reinforcement learning algorithm for LLM reasoning
  2025
• Exploiting Pre-trained Models for Drug Target Affinity Prediction with Nearest Neighbors
  2024