Tom Wollschläger, Nicholas Gao, Bertrand Charpentier, Mohamed Amine Ketata, Stephan Günnemann. Uncertainty Estimation for Molecules: Desiderata and Methods. In Andreas Krause 0001, Emma Brunskill, KyungHyun Cho, Barbara Engelhardt, Sivan Sabato, Jonathan Scarlett, editors, International Conference on Machine Learning, ICML 2023, 23-29 July 2023, Honolulu, Hawaii, USA. Volume 202 of Proceedings of Machine Learning Research, pages 37133-37156, PMLR, 2023. [doi]
@inproceedings{WollschlagerGCK23,
title = {Uncertainty Estimation for Molecules: Desiderata and Methods},
author = {Tom Wollschläger and Nicholas Gao and Bertrand Charpentier and Mohamed Amine Ketata and Stephan Günnemann},
year = {2023},
url = {https://proceedings.mlr.press/v202/wollschlager23a.html},
researchr = {https://researchr.org/publication/WollschlagerGCK23},
cites = {0},
citedby = {0},
pages = {37133-37156},
booktitle = {International Conference on Machine Learning, ICML 2023, 23-29 July 2023, Honolulu, Hawaii, USA},
editor = {Andreas Krause 0001 and Emma Brunskill and KyungHyun Cho and Barbara Engelhardt and Sivan Sabato and Jonathan Scarlett},
volume = {202},
series = {Proceedings of Machine Learning Research},
publisher = {PMLR},
}