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Mathias Niepert

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Structure-Aware E(3)-Invariant Molecular Conformer Aggregation Networks

Feb 03, 2024
Duy M. H. Nguyen, Nina Lukashina, Tai Nguyen, An T. Le, TrungTin Nguyen, Nhat Ho, Jan Peters, Daniel Sonntag, Viktor Zaverkin, Mathias Niepert

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Adaptive Message Passing: A General Framework to Mitigate Oversmoothing, Oversquashing, and Underreaching

Dec 27, 2023
Federico Errica, Henrik Christiansen, Viktor Zaverkin, Takashi Maruyama, Mathias Niepert, Francesco Alesiani

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Uncertainty-biased molecular dynamics for learning uniformly accurate interatomic potentials

Dec 03, 2023
Viktor Zaverkin, David Holzmüller, Henrik Christiansen, Federico Errica, Francesco Alesiani, Makoto Takamoto, Mathias Niepert, Johannes Kästner

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On the Out of Distribution Robustness of Foundation Models in Medical Image Segmentation

Nov 18, 2023
Duy Minh Ho Nguyen, Tan Ngoc Pham, Nghiem Tuong Diep, Nghi Quoc Phan, Quang Pham, Vinh Tong, Binh T. Nguyen, Ngan Hoang Le, Nhat Ho, Pengtao Xie, Daniel Sonntag, Mathias Niepert

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Continual Invariant Risk Minimization

Oct 21, 2023
Francesco Alesiani, Shujian Yu, Mathias Niepert

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Probabilistically Rewired Message-Passing Neural Networks

Oct 15, 2023
Chendi Qian, Andrei Manolache, Kareem Ahmed, Zhe Zeng, Guy Van den Broeck, Mathias Niepert, Christopher Morris

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Approximate Answering of Graph Queries

Aug 12, 2023
Michael Cochez, Dimitrios Alivanistos, Erik Arakelyan, Max Berrendorf, Daniel Daza, Mikhail Galkin, Pasquale Minervini, Mathias Niepert, Hongyu Ren

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Efficient Learning of Discrete-Continuous Computation Graphs

Jul 26, 2023
David Friede, Mathias Niepert

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Learning Disentangled Discrete Representations

Jul 26, 2023
David Friede, Christian Reimers, Heiner Stuckenschmidt, Mathias Niepert

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