Bio-computational modeling, POM analysis and molecular dynamic simulation for novel synthetic quinolone and benzo[d][1,3]oxazine candidates as antimicrobial inhibitors.

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Title: Bio-computational modeling, POM analysis and molecular dynamic simulation for novel synthetic quinolone and benzo[d][1,3]oxazine candidates as antimicrobial inhibitors.
Authors: Elsayed DA; Department of Chemistry, Faculty of Science, Zagazig University, Zagazig, 44519, Egypt. doaaatef@zu.edu.eg., Abdu ME; Department of Chemistry, Faculty of Science, Zagazig University, Zagazig, 44519, Egypt.; Kyushu Universty, Kasuga-KoenKasuga, Fukuoka, 816-8580, Japan., Marzouk MA; Department of pharmaceutical organic Chemistry, Faculty of Pharmacy, Zagazig Universty, Zagazig, 44519, Egypt., Mahmoud EM; Department of pharmaceutical organic Chemistry, Faculty of Pharmacy, Zagazig Universty, Zagazig, 44519, Egypt., El-Shwiniy WH; Department of Chemistry, College of Science, University of Bisha, Bisha, 61922, Saudi Arabia., Spring AM; Kyushu Universty, Kasuga-KoenKasuga, Fukuoka, 816-8580, Japan., Shehab WS; Department of Chemistry, Faculty of Science, Zagazig University, Zagazig, 44519, Egypt.
Source: Scientific reports [Sci Rep] 2024 Nov 20; Vol. 14 (1), pp. 28709. Date of Electronic Publication: 2024 Nov 20.
Publication Type: Journal Article
Journal Info: Publisher: Nature Publishing Group Country of Publication: England NLM ID: 101563288 Publication Model: Electronic Cited Medium: Internet ISSN: 2045-2322 (Electronic) Linking ISSN: 20452322 NLM ISO Abbreviation: Sci Rep Subsets: MEDLINE
Database: MEDLINE Ultimate
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  Data: <searchLink fieldCode="AU" term="%22Elsayed+DA%22">Elsayed DA</searchLink>; Department of Chemistry, Faculty of Science, Zagazig University, Zagazig, 44519, Egypt. doaaatef@zu.edu.eg.<br /><searchLink fieldCode="AU" term="%22Abdu+ME%22">Abdu ME</searchLink>; Department of Chemistry, Faculty of Science, Zagazig University, Zagazig, 44519, Egypt.; Kyushu Universty, Kasuga-KoenKasuga, Fukuoka, 816-8580, Japan.<br /><searchLink fieldCode="AU" term="%22Marzouk+MA%22">Marzouk MA</searchLink>; Department of pharmaceutical organic Chemistry, Faculty of Pharmacy, Zagazig Universty, Zagazig, 44519, Egypt.<br /><searchLink fieldCode="AU" term="%22Mahmoud+EM%22">Mahmoud EM</searchLink>; Department of pharmaceutical organic Chemistry, Faculty of Pharmacy, Zagazig Universty, Zagazig, 44519, Egypt.<br /><searchLink fieldCode="AU" term="%22El-Shwiniy+WH%22">El-Shwiniy WH</searchLink>; Department of Chemistry, College of Science, University of Bisha, Bisha, 61922, Saudi Arabia.<br /><searchLink fieldCode="AU" term="%22Spring+AM%22">Spring AM</searchLink>; Kyushu Universty, Kasuga-KoenKasuga, Fukuoka, 816-8580, Japan.<br /><searchLink fieldCode="AU" term="%22Shehab+WS%22">Shehab WS</searchLink>; Department of Chemistry, Faculty of Science, Zagazig University, Zagazig, 44519, Egypt.
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  Data: <searchLink fieldCode="JN" term="%22101563288%22">Scientific reports</searchLink> [Sci Rep] 2024 Nov 20; Vol. 14 (1), pp. 28709. <i>Date of Electronic Publication: </i>2024 Nov 20.
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              Text: 2024 Nov 20
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