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. 2021 Jun 24;13(13):2080. doi: 10.3390/polym13132080

Figure 6.

Figure 6

Molecular dynamic simulation of an alginate sphere structure in a water box in the presence of GSH and CaCl2. GSH molecules were represented in different colors, and purple dots correspond to CaCl2. Left to right images represent different times of the MD simulation. The center image was rotated 15° on the X axis and 20° on the Y axis in order to better observe the GSH inside the alginate sphere.