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Improved GNNs for Log D7.4 Prediction by Transferring Knowledge from Low-Fidelity Data

Authors :
Yan-Jing Duan
Li Fu
Xiao-Chen Zhang
Teng-Zhi Long
Yuan-Hang He
Zhao-Qian Liu
Ai-Ping Lu
Ya-Feng Deng
Chang-Yu Hsieh
Ting-Jun Hou
Dong-Sheng Cao
Source :
Journal of Chemical Information and Modeling. 63:2345-2359
Publication Year :
2023
Publisher :
American Chemical Society (ACS), 2023.

Details

ISSN :
1549960X and 15499596
Volume :
63
Database :
OpenAIRE
Journal :
Journal of Chemical Information and Modeling
Accession number :
edsair.doi...........9ae9312607a4f358bb62556b34773a7a