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Article title
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Abstract
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Keywords
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Introduction
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Materials and methods
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ADME properties and physicochemical parameters
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Toxicity risk prediction
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Determination of the QSPR
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Density functional calculations
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Molecular docking
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Results and discussion
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ADME properties and physicochemical parameters
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Toxicity risks and drug-likeliness
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Density functional theory (DFT) analysis
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Determination of QSPR
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Molecular docking study
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Conclusion
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Authors’ credit statements
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Availability of data and materials
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Funding
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References
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