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. Author manuscript; available in PMC: 2024 Nov 13.
Published in final edited form as: J Chem Theory Comput. 2018 Dec 20;15(1):625–636. doi: 10.1021/acs.jctc.8b00485

Table 1:

Distribution of folded, misfolded and unfolded states for the three water models and from experiment.31 Representative structures from these states are shown in Fig. 3. Standard error of the mean is shown alongside calculated values.

% Native-like % Compact misfolded % Unfolded
TIP3P 72.0 ± 6.8 26.3 ± 6.3 1.7 ± 0.5
TIP4P/Ew 37.8 ± 12.4 49.6 ± 14.0 12.6 ± 1.6
GB 1.7 ± 0.1 47.9 ± 0.2 50.4 ± 0.3
Experiment 50 0 50