Kohn-Sham approach for fast hybrid density functional calculations in real-space numerical grid methods. - Jaewook Kim; Sungwoo Kang; Jaechang Lim; Sang-Yeon Hwang; Woo Youn Kim (Comput. Phys. Commun., 2018)

Scaffold-based molecular design using graph generative model. - Jaechang Lim; Sang-Yeon Hwang; Seungsu Kim; Seokhyun Moon; Woo Youn Kim (CoRR, 2019)

PIGNet2: A Versatile Deep Learning-based Protein-Ligand Interaction Prediction Model for Binding Affinity Scoring and Virtual Screening. - Seokhyun Moon; Sang-Yeon Hwang; Jaechang Lim; Woo Youn Kim (CoRR, 2023)