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. 2016 Oct 14;2(10):e1600886. doi: 10.1126/sciadv.1600886

Fig. 6. Testing the method using MD-derived results.

Fig. 6

(A) Scoring function φα (Eq. 3) for different normal modes with reference to the MD-derived ζcoh(q,Δt). (B) Comparison of ζcoh(q,Δt) derived from MD with that calculated from the first normal mode with < x2 > NM = 0.44 Å2 required to minimize φα.