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. Author manuscript; available in PMC: 2017 Sep 12.
Published in final edited form as: J Chem Theory Comput. 2017 Aug 8;13(9):4535–4552. doi: 10.1021/acs.jctc.7b00262

Figure 10.

Figure 10

Electron density profiles and x-ray scattering form factor (inset) of the DPPC bilayer system of DPPC at 323 K, obtained from experiment (black line), compared with the results from MD simulations generated using the Drude polarizable force field (red), and the C36 additive force field (blue). The experimental data comes from Kučerka et al,78–80 and the results for the C36 force field were taken from Chowdhary et al.3 The RMSD between the experimental data and the MD simulations is 0.0076 for the new Drude polarizable force field and 0.0115 for the C36 additive force field.

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