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Discovery of novel S6K1 inhibitors by an ensemble-based virtual screening method and molecular dynamics simulation.

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Title: Discovery of novel S6K1 inhibitors by an ensemble-based virtual screening method and molecular dynamics simulation.
Authors: Zhang, Hui1 (AUTHOR) zhanghui123gansu@163.com, Zhang, Hong-Rui1 (AUTHOR), Zhang, Jian1 (AUTHOR), Hu, Mei-Ling1 (AUTHOR), Ren, Li1 (AUTHOR), Luo, Qing-Qing1 (AUTHOR), Qi, Hua-Zhao1 (AUTHOR)
Source: Journal of Molecular Modeling. Apr2023, Vol. 29 Issue 4, p1-17. 17p.
Database: Academic Search Ultimate
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DbLabel: Academic Search Ultimate
An: 163149240
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  Data: Discovery of novel S6K1 inhibitors by an ensemble-based virtual screening method and molecular dynamics simulation.
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  Data: <searchLink fieldCode="AR" term="%22Zhang%2C+Hui%22">Zhang, Hui</searchLink><relatesTo>1</relatesTo> (AUTHOR)<i> zhanghui123gansu@163.com</i><br /><searchLink fieldCode="AR" term="%22Zhang%2C+Hong-Rui%22">Zhang, Hong-Rui</searchLink><relatesTo>1</relatesTo> (AUTHOR)<br /><searchLink fieldCode="AR" term="%22Zhang%2C+Jian%22">Zhang, Jian</searchLink><relatesTo>1</relatesTo> (AUTHOR)<br /><searchLink fieldCode="AR" term="%22Hu%2C+Mei-Ling%22">Hu, Mei-Ling</searchLink><relatesTo>1</relatesTo> (AUTHOR)<br /><searchLink fieldCode="AR" term="%22Ren%2C+Li%22">Ren, Li</searchLink><relatesTo>1</relatesTo> (AUTHOR)<br /><searchLink fieldCode="AR" term="%22Luo%2C+Qing-Qing%22">Luo, Qing-Qing</searchLink><relatesTo>1</relatesTo> (AUTHOR)<br /><searchLink fieldCode="AR" term="%22Qi%2C+Hua-Zhao%22">Qi, Hua-Zhao</searchLink><relatesTo>1</relatesTo> (AUTHOR)
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  Data: <searchLink fieldCode="JN" term="%22Journal+of+Molecular+Modeling%22">Journal of Molecular Modeling</searchLink>. Apr2023, Vol. 29 Issue 4, p1-17. 17p.
PLink https://search.ebscohost.com/login.aspx?direct=true&site=eds-live&db=asn&AN=163149240
RecordInfo BibRecord:
  BibEntity:
    Identifiers:
      – Type: doi
        Value: 10.1007/s00894-023-05504-9
    Languages:
      – Code: eng
        Text: English
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        PageCount: 17
        StartPage: 1
    Titles:
      – TitleFull: Discovery of novel S6K1 inhibitors by an ensemble-based virtual screening method and molecular dynamics simulation.
        Type: main
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      – PersonEntity:
          Name:
            NameFull: Zhang, Hui
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            NameFull: Zhang, Hong-Rui
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            NameFull: Zhang, Jian
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            NameFull: Hu, Mei-Ling
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            NameFull: Ren, Li
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            NameFull: Luo, Qing-Qing
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            NameFull: Qi, Hua-Zhao
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          Dates:
            – D: 01
              M: 04
              Text: Apr2023
              Type: published
              Y: 2023
          Identifiers:
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              Value: 16102940
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              Value: 29
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              Value: 4
          Titles:
            – TitleFull: Journal of Molecular Modeling
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