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Repurposing approved drugs as potential inhibitors of Mycobacterium tuberculosis ClpP: Structure-based virtual screening, molecular dynamics, and in vitro evaluation.

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Title: Repurposing approved drugs as potential inhibitors of Mycobacterium tuberculosis ClpP: Structure-based virtual screening, molecular dynamics, and in vitro evaluation.
Authors: Bhardwaj S; School of Health Sciences and Technology, UPES, Dehradun, Uttarakhand, 248007, India., Roy KK; School of Health Sciences and Technology, UPES, Dehradun, Uttarakhand, 248007, India. kuldeepkroy@gmail.com.
Source: Molecular diversity [Mol Divers] 2026 Aug; Vol. 30 (4), pp. 5621-5639. Date of Electronic Publication: 2026 Jan 14.
Publication Type: Journal Article
Journal Info: Publisher: ESCOM Science Publishers Country of Publication: Netherlands NLM ID: 9516534 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1573-501X (Electronic) Linking ISSN: 13811991 NLM ISO Abbreviation: Mol Divers Subsets: MEDLINE; In Process
Database: MEDLINE Ultimate
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  Data: <searchLink fieldCode="AU" term="%22Bhardwaj+S%22">Bhardwaj S</searchLink>; School of Health Sciences and Technology, UPES, Dehradun, Uttarakhand, 248007, India.<br /><searchLink fieldCode="AU" term="%22Roy+KK%22">Roy KK</searchLink>; School of Health Sciences and Technology, UPES, Dehradun, Uttarakhand, 248007, India. kuldeepkroy@gmail.com.
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  Data: <searchLink fieldCode="JN" term="%229516534%22">Molecular diversity</searchLink> [Mol Divers] 2026 Aug; Vol. 30 (4), pp. 5621-5639. <i>Date of Electronic Publication: </i>2026 Jan 14.
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  Data: <i>Publisher: </i><searchLink fieldCode="PB" term="%22ESCOM+Science+Publishers%22">ESCOM Science Publishers </searchLink><i>Country of Publication: </i>Netherlands <i>NLM ID: </i>9516534 <i>Publication Model: </i>Print-Electronic <i>Cited Medium: </i>Internet <i>ISSN: </i>1573-501X (Electronic) <i>Linking ISSN: </i><searchLink fieldCode="IS" term="%2213811991%22">13811991 </searchLink><i>NLM ISO Abbreviation: </i>Mol Divers <i>Subsets: </i>MEDLINE; In Process
PLink https://search.ebscohost.com/login.aspx?direct=true&site=eds-live&db=mdl&AN=41533012
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      – Type: doi
        Value: 10.1007/s11030-025-11452-8
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      – Code: eng
        Text: English
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        StartPage: 5621
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      – TitleFull: Repurposing approved drugs as potential inhibitors of Mycobacterium tuberculosis ClpP: Structure-based virtual screening, molecular dynamics, and in vitro evaluation.
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            NameFull: Bhardwaj S
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            NameFull: Roy KK
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              Text: 2026 Aug
              Type: published
              Y: 2026
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              Value: 1573-501X
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              Value: 30
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              Value: 4
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            – TitleFull: Molecular diversity
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