Predicting bond dissociation energies of cyclic hypervalent halogen reagents using DFT calculations and graph attention network model

Yingbo Shao, Zhiyuan Ren, Zhihui Han, Li Chen, Yao Li and Xiao-Song Xue
Beilstein J. Org. Chem. 2024, 20, 1444–1452. https://doi.org/10.3762/bjoc.20.127

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Predicting bond dissociation energies of cyclic hypervalent halogen reagents using DFT calculations and graph attention network model
Yingbo Shao, Zhiyuan Ren, Zhihui Han, Li Chen, Yao Li and Xiao-Song Xue
Beilstein J. Org. Chem. 2024, 20, 1444–1452. https://doi.org/10.3762/bjoc.20.127

How to Cite

Shao, Y.; Ren, Z.; Han, Z.; Chen, L.; Li, Y.; Xue, X.-S. Beilstein J. Org. Chem. 2024, 20, 1444–1452. doi:10.3762/bjoc.20.127

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