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Predicting drug-target interaction using 3D structure-embedded graph
  representations from graph neural networks

Predicting drug-target interaction using 3D structure-embedded graph representations from graph neural networks

17 April 2019
Jaechang Lim
Seongok Ryu
Kyubyong Park
Yo Joong Choe
Jiyeon Ham
W. Kim
    GNN
ArXiv (abs)PDFHTML

Papers citing "Predicting drug-target interaction using 3D structure-embedded graph representations from graph neural networks"

5 / 5 papers shown
Title
Graph Neural Networks: A Review of Methods and Applications
Graph Neural Networks: A Review of Methods and Applications
Jie Zhou
Ganqu Cui
Shengding Hu
Zhengyan Zhang
Cheng Yang
Zhiyuan Liu
Lifeng Wang
Changcheng Li
Maosong Sun
AI4CEGNN
1.1K
5,517
0
20 Dec 2018
Graph Attention Networks
Graph Attention Networks
Petar Velickovic
Guillem Cucurull
Arantxa Casanova
Adriana Romero
Pietro Lio
Yoshua Bengio
GNN
479
20,164
0
30 Oct 2017
Neural Message Passing for Quantum Chemistry
Neural Message Passing for Quantum Chemistry
Justin Gilmer
S. Schoenholz
Patrick F. Riley
Oriol Vinyals
George E. Dahl
593
7,455
0
04 Apr 2017
Atomic Convolutional Networks for Predicting Protein-Ligand Binding
  Affinity
Atomic Convolutional Networks for Predicting Protein-Ligand Binding Affinity
Joseph Gomes
Bharath Ramsundar
Evan N. Feinberg
Vijay S. Pande
52
193
0
30 Mar 2017
Interaction Networks for Learning about Objects, Relations and Physics
Interaction Networks for Learning about Objects, Relations and Physics
Peter W. Battaglia
Razvan Pascanu
Matthew Lai
Danilo Jimenez Rezende
Koray Kavukcuoglu
AI4CEOCLPINNGNN
543
1,410
0
01 Dec 2016
1