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Characterizing Uncertainty in Machine Learning for Chemistr:
Heid, Esther
;
McGill, Charles J.
;
Vermeire, Florence H.
.
Journal of Chemical Information and Modeling. 63 (2023) 13 - p. 4012-4029 , 2023
Link:
https://doi.org/10.1021/acs.jcim.3c00373
RT Journal T1 <Title>Characterizing Uncertainty in Machine Learning for Chemistry</Title> UL https://suche.suub.uni-bremen.de/peid=cr-10.1021_acs.jcim.3c00373&Exemplar=1&LAN=DE A1 Heid, Esther A1 McGill, Charles J. A1 Vermeire, Florence H. A1 Green, William H. PB American Chemical Society (ACS) YR 2023 SN 1549-9596 SN 1549-960X JF Journal of Chemical Information and Modeling VO 63 IS 13 SP 4012 OP 4029 LK http://dx.doi.org/https://doi.org/10.1021/acs.jcim.3c00373 DO https://doi.org/10.1021/acs.jcim.3c00373 SF ELIB - SuUB Bremen
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