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. 2024 Jun 18;25(12):6698. doi: 10.3390/ijms25126698

Table 2.

Average Rg, Dmax, and end-to-end distance with SD calculated over a single trajectory in Martini 3 with the solute-solvent scaling parameter λ set to 0.98, 1.00, and 1.02.

Martini Aβ42 with λ = 0.98 Martini Aβ42 with λ = 1.00 Martini Aβ42 with λ = 1.02 Martini Aβ42disul with λ = 0.98 Martini Aβ42disul with λ = 1.00 Martini Aβ42disul with λ = 1.02
Rg (nm) 1.20 ± 0.16 1.32 ± 0.19 1.44 ± 0.22 1.11 ± 0.10 1.18 ± 0.12 1.26 ± 0.13
Dmax (nm) 3.85 ± 0.59 4.20 ± 0.67 4.52 ± 0.71 3.59 ± 0.47 3.83 ± 0.52 4.06 ± 0.55
End-to-end distance (nm) 2.65 ± 0.94 3.00 ± 1.05 3.32 ± 1.11 2.47 ± 0.83 2.70 ± 0.90 2.93 ± 0.94