Note: The 'pml' files in the result should be opened inPyMOL2.
Note: a: Docking score rank with 99 representative structures from 2103 FDA approved drugs, the topper the better (e.g., 3 is better than 20).
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Copyright © 2019 DDDC, SIMM, CAS.
Coded by Yulong Shi,Zhengdan Zhu, Zhaoqiang Chen, Xinben Zhang, Zhijian Xu in Prof. Weiliang Zhu's lab.