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Conformational, Reactivity Analysis, Wavefunction-Based Properties, Molecular Docking and Simulations of a Benzamide Derivative with Potential Antitumor Activity-DFT and MD Simulations.

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Title: Conformational, Reactivity Analysis, Wavefunction-Based Properties, Molecular Docking and Simulations of a Benzamide Derivative with Potential Antitumor Activity-DFT and MD Simulations.
Authors: Al-Otaibi, Jamelah S.1 (AUTHOR), Mary, Y. Sheena2 (AUTHOR), Mary, Y. Shyma2 (AUTHOR), Thirunavukkarasu, M.3,4 (AUTHOR), Trivedi, Ravi5 (AUTHOR), Chakraborty, Brahmananda6,7 (AUTHOR)
Source: Polycyclic Aromatic Compounds. 2023, Vol. 43 Issue 3, p2015-2031. 17p.
Database: Academic Search Ultimate
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  Data: Conformational, Reactivity Analysis, Wavefunction-Based Properties, Molecular Docking and Simulations of a Benzamide Derivative with Potential Antitumor Activity-DFT and MD Simulations.
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  Data: <searchLink fieldCode="JN" term="%22Polycyclic+Aromatic+Compounds%22">Polycyclic Aromatic Compounds</searchLink>. 2023, Vol. 43 Issue 3, p2015-2031. 17p.
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RecordInfo BibRecord:
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      – Type: doi
        Value: 10.1080/10406638.2022.2039229
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      – Code: eng
        Text: English
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        PageCount: 17
        StartPage: 2015
    Titles:
      – TitleFull: Conformational, Reactivity Analysis, Wavefunction-Based Properties, Molecular Docking and Simulations of a Benzamide Derivative with Potential Antitumor Activity-DFT and MD Simulations.
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            NameFull: Al-Otaibi, Jamelah S.
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            NameFull: Mary, Y. Shyma
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            NameFull: Thirunavukkarasu, M.
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            NameFull: Trivedi, Ravi
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            NameFull: Chakraborty, Brahmananda
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            – D: 01
              M: 03
              Text: 2023
              Type: published
              Y: 2023
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            – TitleFull: Polycyclic Aromatic Compounds
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