Cocrystal virtual screening based on the XGBoost machine learning model

Dezhi Yang, Li Wang, Penghui Yuan, Qi An, Bin Su, Mingchao Yu, Ting Chen, Kun Hu, Li Zhang, Yang Lu, Guanhua Du

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Chinese Chemical Letters ›› 2023, Vol. 34 ›› Issue (08) : 107964. DOI: 10.1016/j.cclet.2022.107964
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Cocrystal virtual screening based on the XGBoost machine learning model

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