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A hybrid framework for improving uncertainty quantification in deep learning-based QSAR regression modeling

Published Online: 2021-09-20

Published Print: 2021-12

Authors

Wang, Dingyan

Yu, Jie

Chen, Lifan

Li, Xutong

Jiang, Hualiang

Chen, Kaixian

Zheng, Mingyue

Luo, Xiaomin http://orcid.org/0000-0003-0426-3417
Funding

Funding for this research was provided by:

Opening Funds of Shanghai Key Laboratory of Forensic Medicine (KF1907)

national science & technology major project “key new drug creation and manufacturing program” of china (2018ZX09711002-001-003)

national natural science foundation of china (81773634)

Shanghai Municipal Science and Technology Major Project
License Information

Text and Data Mining valid from 2021-09-20

Version of Record valid from 2021-09-20
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Article History

Received: 16 July 2021

Accepted: 5 September 2021

First Online: 20 September 2021

Declarations

:

: The authors declare no competing financial interest.

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