Table 2 RMSD and NRMSD between AA and CG PMFs before and after each reparameterization stage (1, 2 or 3).

From: Martini compatible coarse-grained model of polyethylenimine for pulmonary gene delivery

  1. Crossed-out cells represent situations where reparameterization was not needed. Shaded cells represent the values for the finalized parameters. RMSD is given in units of kJ mol-1. RMSD and NRMSD between AA and CG PMFs calculated from data in classical Martini literature are included for comparison.
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