qpmax |
maximum positive charge |
qnmax |
maximum negative charge |
Qpos |
total positive charge |
Qneg |
total negative charge |
Qtot |
total absolute charge (electronic charge index - ECI) |
Qmean |
mean absolute charge (charge polarization) |
Q2 |
total squared charge |
RPCG |
relative positive charge |
RNCG |
relative negative charge |
SPP |
submolecular polarity parameter |
TE1 |
topological electronic descriptor |
TE2 |
topological electronic descriptor (bond resctricted) |
PCWTe |
partial charge weighted topological electronic descriptor |
LDI |
local dipole index |