Understanding the representation power of graph neural networks in learning graph topology
Nima Dehmamy, Albert-Laszlo Barabasi, and Rose Yu · 2019
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BERT: Pre-training of deep bidirectional transformers for language understanding
Jacob Devlin, Ming-Wei Chang, Kenton Lee, and Kristina Toutanova · 2019
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Strategies for pre-training graph neural networks
Original
Weihua Hu, Bowen Liu, Joseph Gomes, Marinka Zitnik, Percy Liang, Vijay Pande, and Jure Leskovec · 2019
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Restricted isometry property under high correlations
Original
Shiva Prasad Kasiviswanathan and Mark Rudelson · 2019
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Weisfeiler and leman go neural: Higher-order graph neural networks
Christopher Morris, Martin Ritzert, Matthias Fey, William L Hamilton, Jan Eric Lenssen, Gaurav Rattan, and Martin Grohe · 2019
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Stand-alone self-attention in vision models
Original
Prajit Ramachandran, Niki Parmar, Ashish Vaswani, Irwan Bello, Anselm Levskaya, and Jonathon Shlens · 2019
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Pushing the boundaries of molecular representation for drug discovery with the graph attention mechanism
Zhaoping Xiong, Dingyan Wang, Xiaohong Liu, Feisheng Zhong, Xiaozhe Wan, Xutong Li, Zhaojun Li, Xiaomin Luo, Kaixian Chen, Hualiang Jiang, et al · 2019
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How powerful are graph neural networks?
Keyulu Xu, Weihua Hu, Jure Leskovec, and Stefanie Jegelka · 2019
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Analyzing learned molecular representations for property prediction
Kevin Yang, Kyle Swanson, Wengong Jin, Connor Coley, Philipp Eiden, Hua Gao, Angel Guzman-Perez, Timothy Hopper, Brian Kelley, Miriam Mathea, et al · 2019
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Gnnexplainer: Generating explanations for graph neural networks
Zhitao Ying, Dylan Bourgeois, Jiaxuan You, Marinka Zitnik, and Jure Leskovec · 2019
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Graph transformer networks
Seongjun Yun, Minbyul Jeong, Raehyun Kim, Jaewoo Kang, and Hyunwoo J Kim · 2019
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Aids antiviral screen data
AIDS Antiviral Screen Data · 2020
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Principal neighbourhood aggregation for graph nets
Gabriele Corso, Luca Cavalleri, Dominique Beaini, Pietro Liò, and Petar Veličković · 2020
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An image is worth 16x16 words: Transformers for image recognition at scale
Original
Alexey Dosovitskiy, Lucas Beyer, Alexander Kolesnikov, Dirk Weissenborn, Xiaohua Zhai, Thomas Unterthiner, Mostafa Dehghani, Matthias Minderer, Georg Heigold, Sylvain Gelly, et al · 2020
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Directional message passing for molecular graphs
Original
Johannes Klicpera, Janek Groß, and Stephan Günnemann · 2020
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Molecule attention transformer
Original
Lukasz Maziarka, Tomasz Danel, Slawomir Mucha, Krzysztof Rataj, Jacek Tabor, and Stanislaw Jastrzkebski · 2020
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Exploring the limits of transfer learning with a unified text-to-text transformer
Colin Raffel, Noam Shazeer, Adam Roberts, Katherine Lee, Sharan Narang, Michael Matena, Yanqi Zhou, Wei Li, and Peter J. Liu · 2020
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Grover: Self-supervised message passing transformer on large-scale molecular data
Original
Yu Rong, Yatao Bian, Tingyang Xu, Weiyang Xie, Ying Wei, Wenbing Huang, and Junzhou Huang · 2020
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Exploring self-attention for image recognition
Original
Hengshuang Zhao, Jiaya Jia, and Vladlen Koltun · 2020
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Expressive power of invariant and equivariant graph neural networks
Waiss Azizian and marc lelarge · 2021
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Multi-hop attention graph neural networks
Guangtao Wang, Rex Ying, Jing Huang, and Jure Leskovec · 2021
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