Virtual screening, molecular docking, and molecular dynamics simulation reveal new insights into RNA polymerase inhibition for anti-tuberculosis drug discovery.

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Title: Virtual screening, molecular docking, and molecular dynamics simulation reveal new insights into RNA polymerase inhibition for anti-tuberculosis drug discovery.
Authors: Fakih TM; Department of Pharmaceutical Analysis and Medicinal Chemistry, Faculty of Pharmacy, Universitas Padjadjaran, Sumedang, Indonesia.; Department of Pharmacy, Faculty of Mathematics and Natural Sciences, Universitas Islam Bandung, Bandung, Indonesia., Suarantika F; Department of Pharmacy, Faculty of Mathematics and Natural Sciences, Universitas Islam Bandung, Bandung, Indonesia., Fikri Hidayat A; Department of Pharmacy, Faculty of Mathematics and Natural Sciences, Universitas Islam Bandung, Bandung, Indonesia., Ramadhan DSF; Department of Pharmacy, Poltekkes Kemenkes Makassar, Jl. Baji Gau, Makassar, Indonesia., Muchtaridi M; Department of Pharmaceutical Analysis and Medicinal Chemistry, Faculty of Pharmacy, Universitas Padjadjaran, Sumedang, Indonesia.; Research Collaboration Centre for Radiopharmaceuticals Theranostic, National Research and Innovation Agency (BRIN), Sumedang, Indonesia.
Source: Artificial cells, nanomedicine, and biotechnology [Artif Cells Nanomed Biotechnol] 2025 Dec; Vol. 53 (1), pp. 304-325. Date of Electronic Publication: 2025 Jul 18.
Publication Type: Journal Article
Journal Info: Publisher: Taylor & Francis Country of Publication: England NLM ID: 101594777 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 2169-141X (Electronic) Linking ISSN: 21691401 NLM ISO Abbreviation: Artif Cells Nanomed Biotechnol Subsets: MEDLINE
Database: MEDLINE Ultimate
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  Data: Virtual screening, molecular docking, and molecular dynamics simulation reveal new insights into RNA polymerase inhibition for anti-tuberculosis drug discovery.
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  Data: <searchLink fieldCode="AU" term="%22Fakih+TM%22">Fakih TM</searchLink>; Department of Pharmaceutical Analysis and Medicinal Chemistry, Faculty of Pharmacy, Universitas Padjadjaran, Sumedang, Indonesia.; Department of Pharmacy, Faculty of Mathematics and Natural Sciences, Universitas Islam Bandung, Bandung, Indonesia.<br /><searchLink fieldCode="AU" term="%22Suarantika+F%22">Suarantika F</searchLink>; Department of Pharmacy, Faculty of Mathematics and Natural Sciences, Universitas Islam Bandung, Bandung, Indonesia.<br /><searchLink fieldCode="AU" term="%22Fikri+Hidayat+A%22">Fikri Hidayat A</searchLink>; Department of Pharmacy, Faculty of Mathematics and Natural Sciences, Universitas Islam Bandung, Bandung, Indonesia.<br /><searchLink fieldCode="AU" term="%22Ramadhan+DSF%22">Ramadhan DSF</searchLink>; Department of Pharmacy, Poltekkes Kemenkes Makassar, Jl. Baji Gau, Makassar, Indonesia.<br /><searchLink fieldCode="AU" term="%22Muchtaridi+M%22">Muchtaridi M</searchLink>; Department of Pharmaceutical Analysis and Medicinal Chemistry, Faculty of Pharmacy, Universitas Padjadjaran, Sumedang, Indonesia.; Research Collaboration Centre for Radiopharmaceuticals Theranostic, National Research and Innovation Agency (BRIN), Sumedang, Indonesia.
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  Data: <searchLink fieldCode="JN" term="%22101594777%22">Artificial cells, nanomedicine, and biotechnology</searchLink> [Artif Cells Nanomed Biotechnol] 2025 Dec; Vol. 53 (1), pp. 304-325. <i>Date of Electronic Publication: </i>2025 Jul 18.
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  Data: <i>Publisher: </i><searchLink fieldCode="PB" term="%22Taylor+%26+Francis%22">Taylor & Francis </searchLink><i>Country of Publication: </i>England <i>NLM ID: </i>101594777 <i>Publication Model: </i>Print-Electronic <i>Cited Medium: </i>Internet <i>ISSN: </i>2169-141X (Electronic) <i>Linking ISSN: </i><searchLink fieldCode="IS" term="%2221691401%22">21691401 </searchLink><i>NLM ISO Abbreviation: </i>Artif Cells Nanomed Biotechnol <i>Subsets: </i>MEDLINE
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      – Type: doi
        Value: 10.1080/21691401.2025.2531748
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      – Code: eng
        Text: English
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      – TitleFull: Virtual screening, molecular docking, and molecular dynamics simulation reveal new insights into RNA polymerase inhibition for anti-tuberculosis drug discovery.
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              M: 12
              Text: 2025 Dec
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