ResearchTrend.AI
  • Papers
  • Communities
  • Events
  • Blog
  • Pricing
Papers
Communities
Social Events
Terms and Conditions
Pricing
Parameter LabParameter LabTwitterGitHubLinkedInBlueskyYoutube

© 2025 ResearchTrend.AI, All rights reserved.

  1. Home
  2. Papers
  3. 2406.08210
  4. Cited By
Expressivity and Generalization: Fragment-Biases for Molecular GNNs

Expressivity and Generalization: Fragment-Biases for Molecular GNNs

12 June 2024
Tom Wollschlager
Niklas Kemper
Leon Hetzel
Johanna Sommer
Stephan Günnemann
ArXivPDFHTML

Papers citing "Expressivity and Generalization: Fragment-Biases for Molecular GNNs"

3 / 3 papers shown
Title
Boosting the Cycle Counting Power of Graph Neural Networks with
  I$^2$-GNNs
Boosting the Cycle Counting Power of Graph Neural Networks with I2^22-GNNs
Yinan Huang
Xingang Peng
Jianzhu Ma
Muhan Zhang
76
46
0
22 Oct 2022
Junction Tree Variational Autoencoder for Molecular Graph Generation
Junction Tree Variational Autoencoder for Molecular Graph Generation
Wengong Jin
Regina Barzilay
Tommi Jaakkola
208
1,205
0
12 Feb 2018
MoleculeNet: A Benchmark for Molecular Machine Learning
MoleculeNet: A Benchmark for Molecular Machine Learning
Zhenqin Wu
Bharath Ramsundar
Evan N. Feinberg
Joseph Gomes
C. Geniesse
Aneesh S. Pappu
K. Leswing
Vijay S. Pande
OOD
152
1,748
0
02 Mar 2017
1