From: Global QSAR models of skin sensitisers for regulatory purposes
Symbol | Definition |
---|---|
NN | Number of Nitrogen atoms |
Gnar | Narumi geometric topological index |
X2v | valence connectivity index chi-2 |
Eeig10r | Eigenvalue 10 from edge adj. matrix weighted by resonance integrals |
GGI8 | topological charge index of order 8 |
nCconj | number of non-aromatic conjugated C(sp2) |
O-058 | = O (atom-centred fragments) |