. 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

TABLE 4.

Mean Absolute Deviations (MADs) and Root-Mean-Square Deviations (RMSDs) of Dipole Moments for Ac–(Ala)_n–NHMe (n = 2−6) Not Used for Parametrization, Calculated by the EPAC Method

n	no.^a		mad^b	rmsd^c
2	5		0.19	0.20
3	9		0.36	0.52
4	3		1.27	1.29
5	3		2.13	2.18
6	3		2.71	2.80
		overall av.^d	0.95	1.40

Number of conformations considered.

See footnotes b and c of Table 3.

Overall mean values for all 23 conformations.