[ACS] Atomic Uncertainty Pinpoints Critical Failure Structuresfor Trustworthy Molecular Property Prediction

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journalㄩJournal of Chemical Information and Modeling

AuthorsㄩJiayu Qian; Yukun Luo; Qingping Zhou; Xiaoqing Guan

Published dateㄩ2026-7-27

DOIㄩ10.1021/acs.jcim.6c00973

PDF linkㄩhttps://pubs.acs.org/doi/pdf/10.1021/acs.jcim.6c00973

Article linkㄩhttps://doi.org/10.1021/acs.jcim.6c00973

Article SourceㄩAmerican Chemical Society (ACS)


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