Identification of potential inhibitors of dengue virus ns5 methyltransferase and polymerase domains through virtual screening and molecular dynamics studies.

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Title: Identification of potential inhibitors of dengue virus ns5 methyltransferase and polymerase domains through virtual screening and molecular dynamics studies.
Authors: Haider N; College of Bioscience and Biotechnology, Yangzhou University, Yangzhou Jiangsu Province, 225009, China., Zare A; Department of Biology, Yazd University, Yazd, Iran., Zhou Y; Department of Biosciences and Bioinformatics, School of Science, Xi'an Jiaotong-Liverpool University, Suzhou, Jiangsu, China., Khan FI; Department of Biosciences and Bioinformatics, School of Science, Xi'an Jiaotong-Liverpool University, Suzhou, Jiangsu, China. khanfaeziqbal@gmail.com.
Source: Journal of molecular modeling [J Mol Model] 2026 Jul 08; Vol. 32 (8). Date of Electronic Publication: 2026 Jul 08.
Publication Type: Journal Article
Journal Info: Publisher: Springer Country of Publication: Germany NLM ID: 9806569 Publication Model: Electronic Cited Medium: Internet ISSN: 0948-5023 (Electronic) Linking ISSN: 09485023 NLM ISO Abbreviation: J Mol Model Subsets: MEDLINE
Database: MEDLINE Ultimate
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DbLabel: MEDLINE Ultimate
An: 42418067
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PubType: Academic Journal
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  Data: Identification of potential inhibitors of dengue virus ns5 methyltransferase and polymerase domains through virtual screening and molecular dynamics studies.
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  Data: <searchLink fieldCode="AU" term="%22Haider+N%22">Haider N</searchLink>; College of Bioscience and Biotechnology, Yangzhou University, Yangzhou Jiangsu Province, 225009, China.<br /><searchLink fieldCode="AU" term="%22Zare+A%22">Zare A</searchLink>; Department of Biology, Yazd University, Yazd, Iran.<br /><searchLink fieldCode="AU" term="%22Zhou+Y%22">Zhou Y</searchLink>; Department of Biosciences and Bioinformatics, School of Science, Xi'an Jiaotong-Liverpool University, Suzhou, Jiangsu, China.<br /><searchLink fieldCode="AU" term="%22Khan+FI%22">Khan FI</searchLink>; Department of Biosciences and Bioinformatics, School of Science, Xi'an Jiaotong-Liverpool University, Suzhou, Jiangsu, China. khanfaeziqbal@gmail.com.
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  Data: <searchLink fieldCode="JN" term="%229806569%22">Journal of molecular modeling</searchLink> [J Mol Model] 2026 Jul 08; Vol. 32 (8). <i>Date of Electronic Publication: </i>2026 Jul 08.
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  Data: <i>Publisher: </i><searchLink fieldCode="PB" term="%22Springer%22">Springer </searchLink><i>Country of Publication: </i>Germany <i>NLM ID: </i>9806569 <i>Publication Model: </i>Electronic <i>Cited Medium: </i>Internet <i>ISSN: </i>0948-5023 (Electronic) <i>Linking ISSN: </i><searchLink fieldCode="IS" term="%2209485023%22">09485023 </searchLink><i>NLM ISO Abbreviation: </i>J Mol Model <i>Subsets: </i>MEDLINE
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RecordInfo BibRecord:
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      – Type: doi
        Value: 10.1007/s00894-026-06839-9
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      – Code: eng
        Text: English
    Titles:
      – TitleFull: Identification of potential inhibitors of dengue virus ns5 methyltransferase and polymerase domains through virtual screening and molecular dynamics studies.
        Type: main
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            NameFull: Haider N
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            NameFull: Zare A
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            NameFull: Zhou Y
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            NameFull: Khan FI
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          Dates:
            – D: 08
              M: 07
              Text: 2026 Jul 08
              Type: published
              Y: 2026
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            – Type: issn-electronic
              Value: 0948-5023
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              Value: 32
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              Value: 8
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            – TitleFull: Journal of molecular modeling
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