Table 1.
Base | Atom | Charges | |
AMBER ff14 | Revised | ||
C | N4 | −0.9530 | −0.8716 |
H41/H42 | +0.4234 | +0.3827 | |
U | N3 | −0.3549 | −0.3913 |
H3 | +0.3154 | +0.3518 | |
G | N1 | −0.4787 | −0.5606 |
H1 | +0.3424 | +0.4243 | |
N2 | −0.9672 | −1.0158 | |
H21/H22 | +0.4364 | +0.4607 | |
A | N1 | −0.7615 | −0.7969 |
H2 | +0.0473 | +0.0650 | |
N6 | −0.9019 | −1.0088 | |
H61/H62 | +0.4115 | +0.4738 |
Unlisted atoms have unchanged charges.