@article{reactionatlasaborigineexplorationofchemi, title = {ReactionAtlas: Ab origine exploration of chemical reaction networks with machine learning}, author = {Stefan Gugler and Max Eissler and Khaled Kahouli and Klaus-Robert Müller}, year = {2026}, eprint = {2606.30778}, archivePrefix = {arXiv}, url = {https://arxiv.org/abs/2606.30778}, }