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Computational and Mathematical Methods in Medicine
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Computational and Mathematical Methods in Medicine
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2022
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Article
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Tab 2
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Research Article
Network Pharmacology, Molecular Docking, and Molecular Dynamic-Based Investigation on the Mechanism of Compound Chrysanthemum in the Treatment of Asthenopia
Table 2
Binding energy of active compounds and hub targets.
Target
Compound
Binding energy (kcal/Mol)
PRKACA
Obtusin
-8.8
PRKCA
Ethyl linolenate
-4.7
Glycitein
-7.2
Mandenol
-4.6
Rhein
-8.1
Truflex OBP
-6.0
Wedelolactone
-7.3
PRKCB
Atropine
-6.4
Glycitein
-8.3
Lucidusculine
-7.4
Rhein
-9.0
Wedelolactone
-8.2