Johannes Klicpera

Technical University of Munich — Germany

Computer Science · Physical Sciences

8h-index744citations16works0.02yr avg
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Research Topics

Advanced Graph Neural Networks(12), Computational Drug Discovery Methods(4), Machine Learning in Materials Science(4), Protein Structure and Dynamics(3), Complex Network Analysis Techniques(3)

Publications16 total

Collective Robustness Certificates: Exploiting Interdependence in Graph Neural Networks
arXiv (Cornell University)·2023· 3 citedOpen Access
Directional Message Passing on Molecular Graphs via Synthetic Coordinates
arXiv (Cornell University)·2021· 5 citedOpen Access
Scalable Optimal Transport in High Dimensions for Graph Distances, Embedding Alignment, and More
arXiv (Cornell University)·2021· 3 citedOpen Access
GemNet: Universal Directional Graph Neural Networks for Molecules
arXiv (Cornell University)·2021· 31 citedOpen Access
Warpspeed Computation of Optimal Transport, Graph Distances, and Embedding Alignment
2021
Fast and Uncertainty-Aware Directional Message Passing for Non-Equilibrium Molecules.
arXiv (Cornell University)·2020· 54 citedOpen Access
Efficient Robustness Certificates for Discrete Data: Sparsity-Aware Randomized Smoothing for Graphs, Images and More
arXiv (Cornell University)·2020· 8 citedOpen Access
Efficient Robustness Certificates for Discrete Data: Sparsity-Aware\n Randomized Smoothing for Graphs, Images and More
arXiv (Cornell University)·2020· 5 citedOpen Access
Efficient Robustness Certificates for Graph Neural Networks via Sparsity-Aware Randomized Smoothing
2020
Directional Message Passing for Molecular Graphs
arXiv (Cornell University)·2020· 181 citedOpen Access
Reddit graph dataset in sparse matrix format
Figshare·2020Open Access
Diffusion Improves Graph Learning
arXiv (Cornell University)·2019· 107 citedOpen Access
Personalized Embedding Propagation: Combining Neural Networks on Graphs with Personalized PageRank.
arXiv (Cornell University)·2018· 21 citedOpen Access
Combining Neural Networks with Personalized PageRank for Classification on Graphs
arXiv (Cornell University)·2018· 52 citedOpen Access
Predict then Propagate: Graph Neural Networks meet Personalized PageRank
arXiv (Cornell University)·2018· 267 citedOpen Access
Predict then Propagate: Combining neural networks with personalized pagerank for classification on graphs
mediaTUM (Technical University of Munich)·2018· 7 citedOpen Access

Frequent Co-authors

Stephan Günnemann(15), Aleksandar Bojchevski(8), Marten Lienen(2), Janek Groß(1), Stefan Weißenberger(1), Shankari Giri(1), Johannes T. Margraf(1), Florian Becker(1), Chandan Yeshwanth(1), Jan Schuchardt(1)