Table 6 The list of the descriptors used in the AFP model
Symbol | Definition |
|---|---|
SsOH | Sum of all (-- OH) E-State values in molecule |
Gmin | Smallest atom E-State value in molecule |
BEHv1 | Highest eigenvalue n. 1 of Burden matrix/weighted by atomic van der Waals volumes |
BELe1 | Lowest eigenvalue n. 1 of Burden matrix/weighted by atomic Sanderson electronegativities |
BELp2 | Lowest eigenvalue n. 1 of Burden matrix/weighted by atomic Sanderson electronegativities |
ATS8m | Broto-Moreau autocorrelation of a topological structure - lag 8/weighted by atomic masses |