@inproceedings{pernot:hal-04062457, TITLE = {{Prediction uncertainty in computational chemistry}}, AUTHOR = {Pernot, Pascal}, URL = {https://universite-paris-saclay.hal.science/hal-04062457}, BOOKTITLE = {{Benchmarking of electronic structure methods for non-covalent interactions (CECAM Flagship workshop)}}, ADDRESS = {Champs-sur-Marne, France}, ORGANIZATION = {{Majdi Hochlaf and Ricardo Mata and Daniel Obenchain}}, HAL_LOCAL_REFERENCE = {ICPO\_THEOSIM}, YEAR = {2021}, MONTH = Nov, HAL_ID = {hal-04062457}, HAL_VERSION = {v1}, }