5 citations · 6 across the 4 of their papers we have counts for
Showing 2024Show all
2 papers · 1 filter
q-bio.BM2024★ 5 cited
BInD: Bond and Interaction-generating Diffusion Model for Multi-objective Structure-based Drug Design
Joongwon Lee, Wonho Zhung, Jisu Seo +1
Recent remarkable advancements in geometric deep generative models, coupled with accumulated structural data, enable structure-based drug design (SBDD) using only target protein in…
q-bio.BM2024
DeepBioisostere: Discovering Bioisosteres with Deep Learning for a Fine Control of Multiple Molecular Properties
Hyeongwoo Kim, Seokhyun Moon, Wonho Zhung +3
Optimizing molecular properties while preserving biological activity is a central challenge in drug design. Bioisosteric replacement, which substitutes a molecular fragment with a…