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. 2017 Jul 17;114(31):8265–8270. doi: 10.1073/pnas.1704803114

Fig. 2.

Fig. 2.

Illustration of AMMs on a protein-folding model with true thermodynamics and kinetics shown in green. A representative biased simulation with ΔΔGfold 3kT compared with the true model is shown in blue whereas the AMM-corrected values are shown in magenta. (A) Kinetic network topology. Each state is annotated by its true free energy in kT. (B and C) Equilibrium distributions (solid line) and expectation values (dashed/dashed-dotted lines) of helicity and fluorescence quenching observables. (D and E) Mean first passage times of folding and unfolding, respectively, of biased and AMM models as a function of the degree of bias, ΔΔGfold (Materials and Methods).