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Table 3 List of descriptors, their constructors, description and dimension used in building the QSAR model

From: Predicting the bioactivity of 2-alkoxycarbonylallyl esters as potential antiproliferative agents against pancreatic cancer (MiaPaCa-2) cell lines: GFA-based QSAR and ELM-based models with molecular docking

S/No

Name

Description

Dimension

1

ATSC3c

Centered Broto-Moreau autocorrelation—lag 3/weighted by charges

2D

2

MATS5p

Moran autocorrelation—lag 5/weighted by polarizabilities

2D

3

minHBint5

Minimum E-state descriptors of strength for potential hydrogen bonds of path length 5

2D

4

ETA_Shape_P

Shape index P

2D