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Table 4 Selected descriptors used in the QSAR model

From: Theoretical activity prediction, structure-based design, molecular docking and pharmacokinetic studies of some maleimides against Leishmania donovani for the treatment of leishmaniasis

S/no Descriptor symbol Description Class
1 ATSC6v Centred Broto–Moreau autocorrelation of lag 6 weighted by van der Waals volume 2D
2 GATS5c Geary autocorrelation of lag 5 weighted by gasteiger charge 2D
3 SpMin8_Bhs The smallest absolute eigenvalue of Burden modified matrix − n 8/weighted by relative I-state 2D
4 LOBMIN The L/B ratio for the rotation that results in the minimum area 3D