Descriptor type | Description | Number |
---|---|---|
Constitution | Constitutional descriptors | 30 |
Topology | Topological descriptors | 35 |
Connectivity | Connectivity indices | 44 |
E-state | E-state descriptors | 79 |
Kappa | Kappa shape descriptors | 7 |
Basak | Basak information indices | 21 |
Burden | Burden descriptors | 64 |
Autocorrelation | Morgan autocorrelation | 32 |
Charge | Charge descriptors | 25 |
Property | Molecular property | 6 |
FP2 | A path-based fingerprint which indexes small molecule fragments based on linear segments of up to 7 atoms | 2048 |
MACCS | MACCS keys | 167 |
ECFP2 | An ECFP feature represents a circular substructure around a center atom with diameter is 1 | 2048 |
ECFP4 | An ECFP feature represents a circular substructure around a center atom with diameter is 2 | 2048 |
ECFP6 | An ECFP feature represents a circular substructure around a center atom with diameter is 3 | 2048 |