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Predicting the equivalent alkane carbon number of oils using graph neural networks and quantum mechanical descriptors2025 Computers & Chemical Engineering article Computer Science Computational Drug Discovery Methods Open access
Christoforos Brozos, Jan G. Rittig, Elie Akanny, Philipp Eiden, Alexander Mitsos
1citations -
Literal-Aware Knowledge Graph Embedding for Welding Quality Monitoring: A Bosch Case2023 Lecture notes in computer science conference-paper Computer Science Advanced Graph Neural Networks
Zhipeng Tan, Baifan Zhou, Zhuoxun Zheng, Ognjen Savković, Ziqi Huang, Irlán Grangel González, +2 more
3citations -
Data-driven decoding of quantum error correcting codes using graph neural networks2025 Physical Review Research article Computer Science Quantum Computing Algorithms and Architecture Open access
Moritz Lange, Pontus Havström, Basudha Srivastava, Isak Bengtsson, Valdemar Bergentall, Karl Hammar, +3 more
24citations -
Physical Pooling Functions in Graph Neural Networks for Molecular Property Prediction2022 RWTH Publications (RWTH Aachen) article Computer Science Computational Drug Discovery Methods Open access
Artur M. Schweidtmann, Jan G. Rittig, Jana M. Weber, Martin Grohe, Manuel Dahmen, Kai O. Leonhard, +1 more
3citations -
Accurately Solving Rod Dynamics with Graph Learning2021 King Abdullah University of Science and Technology Repository (King Abdullah University of Science and Technology) conference-paper Computer Science Computer Graphics and Visualization Techniques
Tassilo Kugelstadt, Torsten Hädrich, Wojtek Pałubicki, Jan Bender, Sören Pirk, Dominik Ludewig Michels
6citations