Get our free extension to see links to code for papers anywhere online!

Chrome logo  Add to Chrome

Firefox logo Add to Firefox

DiffBP: Generative Diffusion of 3D Molecules for Target Protein Binding


Nov 21, 2022
Haitao Lin, Yufei Huang, Meng Liu, Xuanjing Li, Shuiwang Ji, Stan Z. Li

* 13 pages 

   Access Paper or Ask Questions

  • Share via Twitter
  • Share via Facebook
  • Share via LinkedIn
  • Share via Whatsapp
  • Share via Messenger
  • Share via Email

Gradient-Guided Importance Sampling for Learning Binary Energy-Based Models


Oct 11, 2022
Meng Liu, Haoran Liu, Shuiwang Ji


   Access Paper or Ask Questions

  • Share via Twitter
  • Share via Facebook
  • Share via LinkedIn
  • Share via Whatsapp
  • Share via Messenger
  • Share via Email

Periodic Graph Transformers for Crystal Material Property Prediction


Sep 23, 2022
Keqiang Yan, Yi Liu, Yuchao Lin, Shuiwang Ji

* This paper has been accepted by NeurIPS 2022. You can also cite the conference version of this paper 

   Access Paper or Ask Questions

  • Share via Twitter
  • Share via Facebook
  • Share via LinkedIn
  • Share via Whatsapp
  • Share via Messenger
  • Share via Email

Learning Protein Representations via Complete 3D Graph Networks


Jul 26, 2022
Limei Wang, Haoran Liu, Yi Liu, Jerry Kurtin, Shuiwang Ji


   Access Paper or Ask Questions

  • Share via Twitter
  • Share via Facebook
  • Share via LinkedIn
  • Share via Whatsapp
  • Share via Messenger
  • Share via Email

FlowX: Towards Explainable Graph Neural Networks via Message Flows


Jun 26, 2022
Shurui Gui, Hao Yuan, Jie Wang, Qicheng Lao, Kang Li, Shuiwang Ji


   Access Paper or Ask Questions

  • Share via Twitter
  • Share via Facebook
  • Share via LinkedIn
  • Share via Whatsapp
  • Share via Messenger
  • Share via Email

GraphFM: Improving Large-Scale GNN Training via Feature Momentum


Jun 18, 2022
Haiyang Yu, Limei Wang, Bokun Wang, Meng Liu, Tianbao Yang, Shuiwang Ji

* ICML 2022 

   Access Paper or Ask Questions

  • Share via Twitter
  • Share via Facebook
  • Share via LinkedIn
  • Share via Whatsapp
  • Share via Messenger
  • Share via Email

ComENet: Towards Complete and Efficient Message Passing for 3D Molecular Graphs


Jun 17, 2022
Limei Wang, Yi Liu, Yuchao Lin, Haoran Liu, Shuiwang Ji


   Access Paper or Ask Questions

  • Share via Twitter
  • Share via Facebook
  • Share via LinkedIn
  • Share via Whatsapp
  • Share via Messenger
  • Share via Email

GOOD: A Graph Out-of-Distribution Benchmark


Jun 16, 2022
Shurui Gui, Xiner Li, Limei Wang, Shuiwang Ji


   Access Paper or Ask Questions

  • Share via Twitter
  • Share via Facebook
  • Share via LinkedIn
  • Share via Whatsapp
  • Share via Messenger
  • Share via Email

Self-Adaptive Label Augmentation for Semi-supervised Few-shot Classification


Jun 16, 2022
Xueliang Wang, Jianyu Cai, Shuiwang Ji, Houqiang Li, Feng Wu, Jie Wang

* 9 pages 

   Access Paper or Ask Questions

  • Share via Twitter
  • Share via Facebook
  • Share via LinkedIn
  • Share via Whatsapp
  • Share via Messenger
  • Share via Email

Lattice Convolutional Networks for Learning Ground States of Quantum Many-Body Systems


Jun 15, 2022
Cong Fu, Xuan Zhang, Huixin Zhang, Hongyi Ling, Shenglong Xu, Shuiwang Ji


   Access Paper or Ask Questions

  • Share via Twitter
  • Share via Facebook
  • Share via LinkedIn
  • Share via Whatsapp
  • Share via Messenger
  • Share via Email
1
2
3
4
5
6
7
>>