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Deep Learning for Protein-Ligand Docking: Are We There Yet?

Deep Learning for Protein-Ligand Docking: Are We There Yet?

23 May 2024
Alex Morehead
Nabin Giri
Jian Liu
Jianlin Cheng
Jianlin Cheng
    OOD
ArXivPDFHTML

Papers citing "Deep Learning for Protein-Ligand Docking: Are We There Yet?"

3 / 3 papers shown
Title
PoseX: AI Defeats Physics Approaches on Protein-Ligand Cross Docking
PoseX: AI Defeats Physics Approaches on Protein-Ligand Cross Docking
Yize Jiang
Xinze Li
Y. Zhang
Jin Han
Youjun Xu
...
Yejin Choi
Wu-Jun Li
Tianfan Fu
Fang Wu
Junhong Liu
40
0
0
03 May 2025
FlowDock: Geometric Flow Matching for Generative Protein-Ligand Docking and Affinity Prediction
FlowDock: Geometric Flow Matching for Generative Protein-Ligand Docking and Affinity Prediction
Alex Morehead
Jianlin Cheng
OOD
107
1
0
14 Dec 2024
DiffDock: Diffusion Steps, Twists, and Turns for Molecular Docking
DiffDock: Diffusion Steps, Twists, and Turns for Molecular Docking
Gabriele Corso
Hannes Stärk
Bowen Jing
Regina Barzilay
Tommi Jaakkola
DiffM
130
399
0
04 Oct 2022
1