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Multi-task Bioassay Pre-training for Protein-ligand Binding Affinity
  Prediction

Multi-task Bioassay Pre-training for Protein-ligand Binding Affinity Prediction

8 June 2023
Jiaxian Yan
Zhaofeng Ye
Ziyi Yang
Chengqiang Lu
Shengyu Zhang
Qi Liu
J. Qiu
ArXivPDFHTML

Papers citing "Multi-task Bioassay Pre-training for Protein-ligand Binding Affinity Prediction"

4 / 4 papers shown
Title
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
Predicting Protein-Ligand Binding Affinity via Joint Global-Local
  Interaction Modeling
Predicting Protein-Ligand Binding Affinity via Joint Global-Local Interaction Modeling
Yang Zhang
G. Zhou
Zhewei Wei
Hongteng Xu
14
9
0
18 Sep 2022
Robust Optimization as Data Augmentation for Large-scale Graphs
Robust Optimization as Data Augmentation for Large-scale Graphs
Kezhi Kong
G. Li
Mucong Ding
Zuxuan Wu
Chen Zhu
Bernard Ghanem
Gavin Taylor
Tom Goldstein
87
74
0
19 Oct 2020
Representation Learning on Graphs with Jumping Knowledge Networks
Representation Learning on Graphs with Jumping Knowledge Networks
Keyulu Xu
Chengtao Li
Yonglong Tian
Tomohiro Sonobe
Ken-ichi Kawarabayashi
Stefanie Jegelka
GNN
220
1,726
0
09 Jun 2018
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