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Zhaojia Dong on Muck Rack

Zhaojia Dong

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Articles

Improvements in chemical reaction pathway exploration algorithms and dataset generation

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By Hanwen Zhang, Bowen Li, Sixuan Mi, Jiabin Yin, Jingbo Wang, Jianyi Ma, Tong Zhu, Zhaojia Dong
| Nature Verified
Abstract Chemical reaction networks provide a comprehensive framework for understanding complex reaction systems, in which reaction path exploration is a critical component. In this study, molecular structures are represented as bond-electron matrices, and reaction candidates are systematically enumerated through matrix transformations.
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