Moon, Seokhyun
- PIGNet: A physics-informed deep learning model toward generalized drug-target interaction predictions
2020/08/22 by Seokhyun Moon, Wonho Zhung, Moon, Seokhyun +7 · 5 citations
Computer Science · Materials Science · Biochemistry, Genetics and Molecular Biology · #Computational Drug Discovery Methods #Machine Learning in Materials Science #Protein Structure and Dynamics
- Discrete Diffusion Schrödinger Bridge Matching for Graph Transformation
2024/10/02 by Kim, Jun Hyeong, Kim, Seonghwan, Moon, Seokhyun +3 · 4 citations
#Artificial Intelligence (cs.AI) #FOS: Computer and information sciences #Machine Learning (cs.LG)
- GeoTMI:Predicting quantum chemical property with easy-to-obtain geometry via positional denoising
2023/03/28 by Kim, Hyeonsu, Woo, Jeheon, Kim, Seonghwan +3 · 1 citation
#Artificial Intelligence (cs.AI) #Chemical Physics (physics.chem-ph) #FOS: Computer and information sciences #FOS: Physical sciences #Machine Learning (cs.LG)
- PIGNet2: A Versatile Deep Learning-based Protein-Ligand Interaction Prediction Model for Binding Affinity Scoring and Virtual Screening
2023/07/03 by Seokhyun Moon, Sang-Yeon Hwang, Moon, Seokhyun +5 · 1 citation
Computer Science · Materials Science · Biochemistry, Genetics and Molecular Biology · #Computational Drug Discovery Methods #Machine Learning in Materials Science #Protein Structure and Dynamics
- FragFM: Hierarchical Framework for Efficient Molecule Generation via Fragment-Level Discrete Flow Matching
2025/02/19 by Lee, Joongwon, Kim, Seonghwan, Moon, Seokhyun +2 · 1 citation
#Artificial Intelligence (cs.AI) #Chemical Physics (physics.chem-ph) #FOS: Computer and information sciences #FOS: Physical sciences #Machine Learning (cs.LG)