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. 2023 Sep 22;102(38):e35029. doi: 10.1097/MD.0000000000035029

Figure 9.

Figure 9

. H-bond interactions and binding free energy analysis during 100 ns MD simulation of luteolin (3,4,5,7-tetrahydroxyflavone) (LUT) in complex with MAPK1 (A, C, and E) and 3CL protease (B, D, and F) protein. MAPK1 = mitogen-activated protein kinase 1.