QSAR Modeling and Molecular Docking Analysis of Some Active Compounds against Mycobacterium tuberculosis Receptor (Mtb CYP121)

Table 6

List of some descriptors used in the QSAR optimization model.

S/number	Descriptors symbols	Name of descriptor(s)	Class
1	AATS7s	Average Moreau-Broto Autocorrelation-lag 7/weighted by I-state	2D
2	nHBint3	Count of E-state descriptors of strength for potential hydrogen bonds of path length 3	2D
3	minHCsatu	Minimum atom-type H E-state: H on C sp3 bonded to unsaturated C	2D
4	TDB9e	3D topological distance based autocorrelation-lag 9/weighted by Sanderson electronegativities	3D
5	RDF90i	Radial distribution function-090/weighted by relative first ionization potential	3D
6	RDF110s	Radial distribution function-110/weighted by relative I-state	3D