Path-Aware and Structure-Preserving Generation of Synthetically Accessible Molecules. - Juhwan Noh; Dae-Woong Jeong; Kiyoung Kim; Sehui Han; Moontae Lee; Honglak Lee; Yousung Jung (ICML, 2022)

CEDe: A collection of expert-curated datasets with atom-level entity annotations for Optical Chemical Structure Recognition. - Rodrigo Hormazabal; Changyoung Park; Soonyoung Lee; Sehui Han; Yeonsik Jo; Jaewan Lee; Ahra Jo; Seung Hwan Kim; Jaegul Choo; Moontae Lee; Honglak Lee (NeurIPS, 2022)

Grouping Matrix Based Graph Pooling with Adaptive Number of Clusters. - Sung Moon Ko; Sungjun Cho; Dae-Woong Jeong; Sehui Han; Moontae Lee; Honglak Lee (AAAI, 2023)

Design of New Inorganic Crystals with the Desired Composition Using Deep Learning. - Seunghee Han; Jaewan Lee; Sehui Han; Seyed Mohamad Moosavi; Jihan Kim; Changyoung Park (J. Chem. Inf. Model., 2023)

Geometrically Aligned Transfer Encoder for Inductive Transfer in Regression Tasks. - Sung Moon Ko; Sumin Lee; Dae-Woong Jeong; Woohyung Lim; Sehui Han (ICLR, 2024)

Multitask Extension of Geometrically Aligned Transfer Encoder. - Sung Moon Ko; Sumin Lee; Dae-Woong Jeong; Hyunseung Kim; Chanhui Lee; Soorin Yim; Sehui Han (CoRR, 2024)

Task Addition in Multi-Task Learning by Geometrical Alignment. - Soorin Yim; Dae-Woong Jeong; Sung Moon Ko; Sumin Lee; Hyunseung Kim; Chanhui Lee; Sehui Han (CoRR, 2024)

Scalable Multi-Task Transfer Learning for Molecular Property Prediction. - Chanhui Lee; Dae-Woong Jeong; Sung Moon Ko; Sumin Lee; Hyunseung Kim; Soorin Yim; Sehui Han; Sungwoong Kim; Sungbin Lim (CoRR, 2024)

3D Denoisers Are Good 2D Teachers: Molecular Pretraining via Denoising and Cross-Modal Distillation. - Sungjun Cho; Dae-Woong Jeong; Sung Moon Ko; Jinwoo Kim; Sehui Han; Seunghoon Hong; Honglak Lee; Moontae Lee (AAAI, 2025)

Mol-LLM: Generalist Molecular LLM with Improved Graph Utilization. - Chanhui Lee; Yuheon Song; Yongjun Jeong; Hanbum Ko; Rodrigo Hormazabal; Sehui Han; Kyunghoon Bae; Sungbin Lim; Sungwoong Kim (CoRR, 2025)

CAST: Cross Attention based multimodal fusion of Structure and Text for materials property prediction. - Jaewan Lee; Changyoung Park; Hongjun Yang; Sungbin Lim; Sehui Han (CoRR, 2025)

MolMole: Molecule Mining from Scientific Literature. - LG AI Research; Sehyun Chun; Jiye Kim; Ahra Jo; Yeonsik Jo; Seungyul Oh; Seungjun Lee; Kwangrok Ryoo; Jongmin Lee; Seung Hwan Kim; Byung Jun Kang; Soonyoung Lee; et al. (CoRR, 2025)

Geometric Embedding Alignment via Curvature Matching in Transfer Learning. - Sung Moon Ko; Jaewan Lee; Sumin Lee; Soorin Yim; Kyunghoon Bae; Sehui Han (CoRR, 2025)