Tien Dat Nguyen

I am a Master of Mathematics student in Computer Science at the University of Waterloo and an affiliate of the Vector Institute, being supervised by Professor Victor Zhong. I am driven by a mission to apply foundational Machine Learning research to critical challenges in AI Safety and the acceleration of Scientific Discovery, with a focus on domains like Drug Discovery and Material Discovery.

I earned my Bachelor's in Computer Science from the Korea Advanced Institute of Science and Technology (KAIST), where my expertise was grounded in 2.5 years of research at KAIST’s Vision & Learning Lab. There, I researched under the supervision of Professor Seunghoon Hong and Professor Hongseok Yang, and was mentored by Dr. Jinwoo Kim. My research focused on the topics of Geometric Deep Learning and Graph Machine Learning.

I have also applied my skills in industry at BionSight, a Drug Discovery startup, where I developed an LC-MS quantification algorithm for measuring molecular abundance, supporting their drug discovery pipeline.

Moving forward, I am focusing my research on two core areas. I am committed to accelerating Scientific Discovery in areas like Drug Discovery and Material Discovery, alongside a dedication to advancing AI Safety by developing safe-by-design AI systems. Technically, I am exploring these problems through Probabilistic Modeling and Inference, and advanced Generative models, particularly GFlowNets and LLMs.

CV  /  Google Scholar  /  GitHub  /  Twitter  /  LinkedIn

profile photo

News

Sep 2024: I start my graduate study at Waterloo University.
Feb 2024: I graduated from KAIST University.

Publications

* denotes equal contribution.

Learning Symmetrization for Equivariance with Orbit Distance Minimization
Tien Dat Nguyen*, Jinwoo Kim*, Hongseok Yang, Seunghoon Hong
NeurIPS Workshop on Symmetry and Geometry in Neural Representations, 2023
paper / code / poster
Learning Probabilistic Symmetrization for Architecture Agnostic Equivariance
Jinwoo Kim,Tien Dat Nguyen, Ayhan Suleymanzade, Hyeokjun An, Seunghoon Hong
NeurIPS, 2023  (Spotlight Presentation, Top 3% of Submissions)
paper / code / poster / slides (extended)
Pure Transformers are Powerful Graph Learners
Jinwoo Kim, Tien Dat Nguyen, Seonwoo Min, Sungjun Cho, Moontae Lee, Honglak Lee, Seunghoon Hong
NeurIPS, 2022
Slated for official integration in PyTorch Geometric (PyG) library, as mentioned in technical paper
paper / code / Invited talk / poster / slides (extended)

Experience

Vector Institute
Graduate student researcher, 2024-2026

Reading to Learn Lab
Graduate student researcher, 2024-2026 (Advisor: Prof. Victor Zhong)

BionSight
Machine Learning Engineer, 2024

Vision & Learning Lab
Research Intern, 2021-2023 (Advisors: Prof. Seunghoon Hong, Prof. Hongseok Yang and Dr. Jinwoo Kim)

Honors and Awards

Excellence Award, Undegraduate Research Program (KAIST), Spring 2022
Recipient, Dean's List (KAIST), Spring 2021
National Finalist (Top 42), Shortlisted for Vietnam IMO Team selection (TST), 2018
First Prize (Ranked 5th), Vietnam National Olympiad Mathematics, 2018
Third Prize, Vietnam National Olympiad Mathematics, 2017


Last updated: November 2025


Built from Jon Barron's academic website