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Organic and Medicinal Chemistry Letters

Table 2 Uni-column statistics of the training and test sets for QSAR models

From: 2D, 3D-QSAR and docking studies of 1,2,3-thiadiazole thioacetanilides analogues as potent HIV-1 non-nucleoside reverse transcriptase inhibitors

Data set

Column name

Average

Max.

Min.

SD

Sum

2D-QSAR

Training

pEC50(μM)

5.9092

7.2300

4.5800

0.9019

70.9100

Test

pEC50(μM)

5.6940

6.9300

4.8600

0.6500

56.9400

3D-QSAR

Training

pEC50(μM)

5.8417

7.2300

4.5800

0.7859

105.1500

Test

pEC50(μM)

5.6750

6.9300

4.8600

0.8967

22.7000

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