Table 11 MMGBSA of IL-1B curcumin AI Ligand 3 complex.

From: Natural AI-based drug designing by modification of ascorbic acid and curcumin to combat buprofezin toxicity by using molecular dynamics study

Energy component

Average

Std. dev.

Std. err. of mean

VDWAALS

− 52.2473

4.9195

1.5557

EEL

− 26.7441

5.6438

1.7847

EGB

48.2068

4.9880

1.5773

ESURF

− 6.4227

0.4635

0.1466

DELTA G gas

− 78.9914

7.0064

2.2156

DELTA G solv

41.7841

4.8516

1.5342

DELTA TOTAL

− 37.2074

5.0900

1.6096

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