Hyukjun Lim

I build AI methods for chemical discovery: machine-learning interatomic potentials, reaction-condition prediction, and molecular binding.

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Position
First-year M.S./Ph.D. student, Chemical and Biological Engineering
Institution
Seoul National University
Advisor
Yousung Jung
Field
AI for chemistry

2Peer-reviewed papers
3Workshop papers
$71,500Scholarships awarded
3 / 67Class rank, summa cum laude

01

About

I’m a first-year M.S./Ph.D. student in Chemical and Biological Engineering at Seoul National University, advised by Yousung Jung.

My work integrates artificial intelligence with chemistry: developing AI-driven methods that accelerate chemical discovery and engineering, from interatomic potentials to reaction-condition prediction.

To date, two peer-reviewed papers and three workshop papers, written with collaborators at SNU, POSTECH and MIT.

Interests

Machine-learning interatomic potentials, reaction-condition prediction, protein–ligand binding, and materials discovery.

Hyukjun Lim

02

News


03

Education

2026 — Present

M.S./Ph.D. in Chemical and Biological Engineering

Seoul National University — PI: Yousung Jung

GPA 4.0 / 4.3

Transcript
2022 — 2026

B.S. in Materials Science and Engineering & Artificial Intelligence

Seoul National University

GPA 4.09 / 4.3

Summa Cum Laude, ranked 3/67 in the department

Transcript

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Publications

Hyukjun Lim, Yousung Jung

ICML Workshop on AI for Science

Hyukjun Lim*, Seokhyun Choung*, Jinuk Moon, Jeong Woo Han

npj Computational Materials

Hyukjun Lim*, Soojung Yang*, Lucas Pinede*, Miguel Steiner, Yuanqi Du, Rafael Gómez-Bombarelli

NeurIPS Workshop on Frontiers in Probabilistic Inference

Hyukjun Lim, Sun Kim, Sangseon Lee

ICLR

* Equal contribution


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Curriculum vitae

Download CV
Awards
2026Presidential Science Scholarship for Graduate Students
2026AI Seoul Tech Scholarship
2025Excellence Award, Deep Learning-based Product Recognition AI Competition
2024Kwanjeong Educational Foundation Scholarship
Teaching

Two years of mentoring experience, teaching undergraduate students in machine learning and computational chemistry.


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Contact

Open to collaborations, questions about the work, and conversations about AI for chemistry.