Molecular Graph Generation via Geometric Scattering

12 October 2021

Papers citing "Molecular Graph Generation via Geometric Scattering"

21 / 21 papers shown

Title
Geometric Scattering on Measure Spaces Joyce A. Chew M. Hirn Smita Krishnaswamy Deanna Needell Michael Perlmutter H. Steach Siddharth Viswanath Hau‐Tieng Wu GNN 204 19 0 17 Aug 2022
Overcoming Oversmoothness in Graph Convolutional Networks via Hybrid Scattering Networks Frederik Wenkel Yimeng Min M. Hirn Michael Perlmutter Guy Wolf GNN 85 24 0 22 Jan 2022
Geometric Scattering Attention Networks Yimeng Min Frederik Wenkel Guy Wolf 118 9 0 28 Oct 2020
Data-Driven Learning of Geometric Scattering Networks Alexander Tong Frederik Wenkel Kincaid MacDonald Smita Krishnaswamy Guy Wolf GNN 38 5 0 06 Oct 2020
MoFlow: An Invertible Flow Model for Generating Molecular Graphs Chengxi Zang Fei Wang BDL 134 295 0 17 Jun 2020
Scattering GCN: Overcoming Oversmoothness in Graph Convolutional Networks Yimeng Min Frederik Wenkel Guy Wolf GNN 145 114 0 18 Mar 2020
Hierarchical Generation of Molecular Graphs using Structural Motifs Wengong Jin Regina Barzilay Tommi Jaakkola 94 289 0 08 Feb 2020
GraphAF: a Flow-based Autoregressive Model for Molecular Graph Generation Chence Shi Minkai Xu Zhaocheng Zhu Weinan Zhang Ming Zhang Jian Tang 198 438 0 26 Jan 2020
Node Masking: Making Graph Neural Networks Generalize and Scale Better Pushkar Mishra Aleksandra Piktus Gerard Goossen Fabrizio Silvestri AI4CE 66 14 0 17 Jan 2020
Graph Transformer Networks Seongjun Yun Minbyul Jeong Raehyun Kim Jaewoo Kang Hyunwoo J. Kim 154 986 0 06 Nov 2019
Stability of Graph Scattering Transforms Fernando Gama Joan Bruna Alejandro Ribeiro GNN 69 85 0 11 Jun 2019
Labeled Graph Generative Adversarial Networks Shuangfei Fan Bert Huang GAN 68 30 0 07 Jun 2019
MixHop: Higher-Order Graph Convolutional Architectures via Sparsified Neighborhood Mixing Sami Abu-El-Haija Bryan Perozzi Amol Kapoor N. Alipourfard Kristina Lerman Hrayr Harutyunyan Greg Ver Steeg Aram Galstyan GNN 105 918 0 30 Apr 2019
Geometric Scattering for Graph Data Analysis Feng Gao Guy Wolf M. Hirn GNN 91 113 0 07 Oct 2018
Diffusion Scattering Transforms on Graphs Fernando Gama Alejandro Ribeiro Joan Bruna GNN 94 103 0 22 Jun 2018
MolGAN: An implicit generative model for small molecular graphs Nicola De Cao Thomas Kipf GNN GAN 181 930 0 30 May 2018
Graph Convolutional Neural Networks via Scattering Dongmian Zou Gilad Lerman GNN 71 123 0 31 Mar 2018
Fréchet ChemNet Distance: A metric for generative models for molecules in drug discovery Kristina Preuer Philipp Renz Thomas Unterthiner Sepp Hochreiter Günter Klambauer MedIm 103 340 0 26 Mar 2018
Automatic chemical design using a data-driven continuous representation of molecules Rafael Gómez-Bombarelli Jennifer N. Wei David Duvenaud José Miguel Hernández-Lobato Benjamín Sánchez-Lengeling Dennis Sheberla J. Aguilera-Iparraguirre Timothy D. Hirzel Ryan P. Adams Alán Aspuru-Guzik 3DV 189 2,945 0 07 Oct 2016
Semi-Supervised Classification with Graph Convolutional Networks Thomas Kipf Max Welling GNN SSL 709 29,220 0 09 Sep 2016
Group Invariant Scattering S. Mallat 135 993 0 12 Jan 2011