Items where Author is "Busk, Jonas"

Busk, Jonas and Bjørn Jørgensen, Peter and Bhowmik, Arghya and Schmidt, Mikkel N and Winther, Ole and Vegge, Tejs (2022) Calibrated uncertainty for molecular property prediction using ensembles of message passing neural networks. Machine Learning: Science and Technology, 3 (1). 015012. ISSN 2632-2153