People
The researchers behind Yu Lab's molecular modeling work.
Principal Investigator
Ji Woong Yu유지웅
Assistant Professor
School of Frontier SciencesDepartment of ChemistryAjou University
Education
Ph.D., Chemical and Biological Engineering
Seoul National University
Advisor: Prof. Won Bo Lee
B.S., Chemical Engineering (Summa Cum Laude)
Chung-Ang University
GPA: 4.31 / 4.50
Experience
Assistant Professor
Ajou University
School of Frontier Sciences
Department of Chemistry
AI Research Fellow
Korea Institute for Advanced Study (KIAS)
Center for AI and Natural Sciences
Advisor: Prof. Changbong Hyeon
Postdoctoral Research Fellow
Seoul National University
Department of Chemical and Biological Engineering
Honors
Young WATOC Lecture
WATOC 2025, Oslo
Dongjin Outstanding Paper Award
Seoul National University, 2022
Summa Cum Laude
Chung-Ang University, 2016
Technical Skills
Molecular SimulationLAMMPS, GROMACS, HOOMD-blue
First-Principles CalculationsVASP, CP2K, Quantum ESPRESSO, Gaussian, PySCF
Machine-Learned PotentialsDeePMD-kit, MACE, NequIP, JAX-MD
VisualizationVMD, OVITO
ProgrammingPython, C++, JAX, CUDA, OpenMP/MPI
InfrastructurePBS, SGE, Slurm, Docker
Professional Activities
- American Physical Society (APS)
- American Chemical Society (ACS)
- International Centre for Multiscale Simulations (ICMS)
- World Association of Theoretical and Computational Chemists (WATOC)
Lab Members
New members will appear here as they join.