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Table 1 Type and number of drug molecule descriptors

From: Quantitative prediction model for affinity of drug–target interactions based on molecular vibrations and overall system of ligand-receptor

Serial number Descriptor type Number of descriptors
1 Constitutional descriptors 120
2 Autocorrelation descriptors 346
3 Basak descriptors 42
4 BCUT descriptors 6
5 Burden descriptors 96
6 Connectivity descriptors 56
7 E-state descriptors 489
8 Kappa descriptors 3
9 Molecular property descriptors 15
10 Quantum chemical descriptors 5
11 Topological descriptors 265
12 CPSA descriptors 29
13 RDF descriptors 210
14 Geometrical descriptors 21
15 WHIM descriptors 91
16 3D Autocorrelation descriptors 80