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. Author manuscript; available in PMC: 2008 Jul 15.
Published in final edited form as: J Phys Chem B. 2008 Apr 10;112(17):5470–5478. doi: 10.1021/jp711484f

Figure 3.

Figure 3

Comparison of dipole moments μEPAC calculated with EPAC charges with dipole moments μB3LYP computed directly at the B3LYP/6-31G(d,p) level for representative conformations of Ac–(Ala)n–NHMe (n = 2−6) not used for parametrization, units in Debyes: n = 2, ●; n = 3, ○; n = 4, ▲; n = 5, ∆; n = 6, ■.