D3R Grand Challenge 2 Achievements
We are excited to announce that our team’s prediction was ranked 1st for Set 1 (Stage 2) in the D3R Grand Challenge 2.
You can view the full report here: Download Report
Duc Nguyen
Associate Professor of Mathematics
Duc Nguyen develops mathematical and AI frameworks for molecular bioscience, drug discovery, and scientific computing. His group blends differential geometry, graph theory, and machine learning to build high-fidelity models for biomolecular systems, with notable wins in the D3R Grand Challenges and collaborations with Pfizer and Bristol Myers Squibb. Supported by multiple NSF awards, he has advised students and postdocs across theory and applications of AI-driven drug design.