Klaser, Kerstin

3 publications

ICMLW 2024 MiniMol: A Parameter-Efficient Foundation Model for Molecular Learning Kerstin Klaser, Blazej Banaszewski, Samuel Maddrell-Mander, Callum McLean, Luis Müller, Ali Parviz, Shenyang Huang, Andrew W Fitzgibbon

ICLR 2024 Towards Foundational Models for Molecular Learning on Large-Scale Multi-Task Datasets Dominique Beaini, Shenyang Huang, Joao Alex Cunha, Zhiyi Li, Gabriela Moisescu-Pareja, Oleksandr Dymov, Samuel Maddrell-Mander, Callum McLean, Frederik Wenkel, Luis Müller, Jama Hussein Mohamud, Ali Parviz, Michael Craig, Michał Koziarski, Jiarui Lu, Zhaocheng Zhu, Cristian Gabellini, Kerstin Klaser, Josef Dean, Cas Wognum, Maciej Sypetkowski, Guillaume Rabusseau, Reihaneh Rabbany, Jian Tang, Christopher Morris, Mirco Ravanelli, Guy Wolf, Prudencio Tossou, Hadrien Mary, Therence Bois, Andrew W Fitzgibbon, Blazej Banaszewski, Chad Martin, Dominic Masters

NeurIPS 2023 Generating QM1B with PySCF$_{\text{IPU}}$ Alexander Mathiasen, Hatem Helal, Kerstin Klaser, Paul Balanca, Josef Dean, Carlo Luschi, Dominique Beaini, Andrew W. Fitzgibbon, Dominic Masters