Quantitative investigation of the nature of non-covalent interactions in
            <i>2-((benzo[d]</i>
            [1,3]
            <i>dioxol-5-ylmethyl)amino)-N-phenyl-2-thioxoacetamide</i>
            : insights from crystallographic, DFT analysis, molecular docking, and molecular dynamics simulation

Lohith, T. N.; Ravi Singh, K.; Feizi-Dehnayebi, Mehran; Santhosh, C.; Kishorkumar, S.; Sridhar, M. A.; Sadashiva, M. P.

doi:10.1080/00268976.2024.2444467

Molecular Physics

2024

DOI: 10.1080/00268976.2024.2444467

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Quantitative investigation of the nature of non-covalent interactions in 2-((benzo[d] [1,3] dioxol-5-ylmethyl)amino)-N-phenyl-2-thioxoacetamide : insights from crystallographic, DFT analysis, molecular docking, and molecular dynamics simulation

T. N. Lohith,

K. Ravi Singh,

Mehran Feizi-Dehnayebi

et al.

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Quantitative investigation of the nature of non-covalent interactions in 2-((benzo[d] [1,3] dioxol-5-ylmethyl)amino)-N-phenyl-2-thioxoacetamide : insights from crystallographic, DFT analysis, molecular docking, and molecular dynamics simulation

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References 45 publications

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