Binding-Adaptive Diffusion Models for Structure-Based Drug Design

15 January 2024

Papers citing "Binding-Adaptive Diffusion Models for Structure-Based Drug Design"

8 / 8 papers shown

Title
Integrating Protein Dynamics into Structure-Based Drug Design via Full-Atom Stochastic Flows Xiangxin Zhou Yi Xiao Haowei Lin Xinheng He Jiaqi Guan Yang Wang Qiang Liu F. I. S. Kevin Zhou Liang Wang Jianzhu Ma AI4CE 50 0 0 06 Mar 2025
TurboHopp: Accelerated Molecule Scaffold Hopping with Consistency Models Kiwoong Yoo Owen Oertell Junhyun Lee Sanghoon Lee Jaewoo Kang 31 0 0 28 Oct 2024
General Binding Affinity Guidance for Diffusion Models in Structure-Based Drug Design Yue Jian Curtis Wu Danny Reidenbach Aditi S. Krishnapriyan 29 1 0 24 Jun 2024
$Diffusion Models in $\textit{De Novo}$ Drug Design$ Diffusion Models in $\textit{De Novo}$ Drug Design Amira Alakhdar Barnabás Póczos Newell Washburn MedIm 29 11 0 07 Jun 2024
Motion-aware Latent Diffusion Models for Video Frame Interpolation Zhilin Huang Yijie Yu Ling Yang C. Qin Bing Zheng Xiawu Zheng Zikun Zhou Yaowei Wang Wenming Yang VGen DiffM 21 7 0 21 Apr 2024
A Systematic Survey in Geometric Deep Learning for Structure-based Drug Design Zaixin Zhang Jiaxian Yan Qi Liu Enhong Chen Marinka Zitnik 25 1 0 20 Jun 2023
A 3D Generative Model for Structure-Based Drug Design Shitong Luo Jiaqi Guan Jianzhu Ma Jian-wei Peng DiffM 65 176 0 20 Mar 2022
Geometric Deep Learning: Grids, Groups, Graphs, Geodesics, and Gauges M. Bronstein Joan Bruna Taco S. Cohen Petar Velivcković GNN 166 1,095 0 27 Apr 2021