Graph Multi-Similarity Learning for Molecular Property Prediction

31 January 2024

Papers citing "Graph Multi-Similarity Learning for Molecular Property Prediction"

15 / 15 papers shown

Title
Motif-based Graph Representation Learning with Application to Chemical Molecules Yifei Wang Shiyang Chen Guobin Chen Ethan Shurberg Hang Liu Pengyu Hong GNN 45 14 0 09 Aug 2022
Pre-training Molecular Graph Representation with 3D Geometry Shengchao Liu Hanchen Wang Weiyang Liu Joan Lasenby Hongyu Guo Jian Tang 161 316 0 07 Oct 2021
GeomGCL: Geometric Graph Contrastive Learning for Molecular Property Prediction Shuangli Li Jingbo Zhou Tong Xu Dejing Dou Hui Xiong AI4CE 50 122 0 24 Sep 2021
Chemical-Reaction-Aware Molecule Representation Learning Hongwei Wang Weijian Li Xiaomeng Jin Kyunghyun Cho Heng Ji Jiawei Han Martin D. Burke 129 60 0 21 Sep 2021
ChemRL-GEM: Geometry Enhanced Molecular Representation Learning for Property Prediction Xiaomin Fang Lihang Liu Jieqiong Lei Donglong He Shanzhuo Zhang Jingbo Zhou Fan Wang Hua Wu Haifeng Wang AI4CE 50 446 0 11 Jun 2021
Graph Self-Supervised Learning: A Survey Yixin Liu Ming Jin Shirui Pan Chuan Zhou Yu Zheng Feng Xia Philip S. Yu SSL 92 563 0 27 Feb 2021
A Survey on Contrastive Self-supervised Learning Ashish Jaiswal Ashwin Ramesh Babu Mohammad Zaki Zadeh Debapriya Banerjee F. Makedon SSL 117 1,389 0 31 Oct 2020
Self-supervised Learning: Generative or Contrastive Xiao Liu Fanjin Zhang Zhenyu Hou Zhaoyu Wang Li Mian Jing Zhang Jie Tang SSL 121 1,612 0 15 Jun 2020
Strategies for Pre-training Graph Neural Networks Weihua Hu Bowen Liu Joseph Gomes Marinka Zitnik Percy Liang Vijay S. Pande J. Leskovec SSL AI4CE 108 1,398 0 29 May 2019
Analyzing Learned Molecular Representations for Property Prediction Kevin Kaichuang Yang Kyle Swanson Wengong Jin Connor W. Coley Philipp Eiden ... Andrew Palmer Volker Settels Tommi Jaakkola K. Jensen Regina Barzilay 96 1,314 0 02 Apr 2019
Unsupervised Feature Learning via Non-Parametric Instance-level Discrimination Zhirong Wu Yuanjun Xiong Stella X. Yu Dahua Lin SSL 170 3,450 0 05 May 2018
Neural Message Passing for Quantum Chemistry Justin Gilmer S. Schoenholz Patrick F. Riley Oriol Vinyals George E. Dahl 533 7,431 0 04 Apr 2017
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 323 1,825 0 02 Mar 2017
Deep Metric Learning via Lifted Structured Feature Embedding Hyun Oh Song Yu Xiang Stefanie Jegelka Silvio Savarese FedML SSL DML 94 1,641 0 19 Nov 2015
FaceNet: A Unified Embedding for Face Recognition and Clustering Florian Schroff Dmitry Kalenichenko James Philbin 3DH 344 13,134 0 12 Mar 2015