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. 2020 Dec 9;25(24):5808. doi: 10.3390/molecules25245808

Figure 3.

Figure 3

(a) Identification of the active site in the vicinity of the Cys145 using the ProBiS server and superposition of the small-molecule ligands from the locally aligned complexes at the 3CLpro active site; (b) the resulting extended docking grid calculated by Make Receptor of the OpenEye software.