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. 2021 Feb 17;6(8):5786–5794. doi: 10.1021/acsomega.0c06191

Figure 2.

Figure 2

2D summary diagram of the MD-calculated contacts between CHIKV nsP2 (PDB ID: 3TRK) and compounds 1 (a), 10 (b), 10b (c), and 10c (d). Interactions that occur more than 10% of the simulation time are shown.