An optimization algorithm for conformer generation based on the bond contribution ranking
Autor: | Zhang, Ziheng, Zhang, Kai, Liu, Zhihui, Zhao, Jialei, Wang, Jing, Dang, Yongjun, Hu, Junchi |
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Zdroj: | In Computational Biology and Chemistry October 2022 100 |
Databáze: | ScienceDirect |
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