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. 2023 May 10;63(10):3030–3042. doi: 10.1021/acs.jcim.3c00138

Figure 17.

Figure 17

Representative conformation of the main cluster of ID2. (Left) Clusters obtained from extended simulations; (right) clusters obtained from misfolded simulations. The percentage of frames (pop%) comprising the clusters and the backbone RMSD between the representative conformation and the native conformation are also shown.