Fig. 8.

A. Theoretical intermediate scattering function $I(\widehat{\mathbf{q}},t)$ of non-exchangeable protons calculated directly from a molecular dynamics trajectory of the protein myoglobin in solution and after multiplying the MD result by various resolution functions corresponding to different instrumental resolutions. B. Incoherent dynamic structure factors $S(\widehat{\mathbf{q}},\mathrm{E})$ of the protein α-lactalbumin at selected magnitudes of momentum transfer ($\left|\widehat{\mathbf{q}}\right|=$0.5, 1.0, and 1.5 Å ⁻¹ from bottom to top) measured by quasielastic neutron scattering (boxes) and predicted from MD simulations of the protein in solution (lines).

Source: Reprinted from reference [72] with permission from Elsevier.