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Antifungal activity and biocompatibility assessment with molecular docking and dynamic simulations of new pyrazole derivatives.

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Title: Antifungal activity and biocompatibility assessment with molecular docking and dynamic simulations of new pyrazole derivatives.
Authors: Abd-Elhalim BT; Department of Agricultural Microbiology, Faculty of Agriculture, Ain Shams University, PO Box 68, Hadayek Shoubra, Shubra El-Khaimah, Cairo, 11241, Egypt. basma.talaat@agr.asu.edu.eg., El-Bana GG; Department of Chemistry, Faculty of Science, Mansoura University, El-Gomhoria Street, Mansoura, ET-35516, Egypt.; Mansoura University Student's Hospital, Mansoura University, El-Gomhoria Street, Mansoura, ET-35516, Egypt., El-Sayed AF; Microbial Genetics Department, Biotechnology Research Institute, National Research Centre, Giza, Dokki, 12622, Egypt.; Egypt Center for Research and Regenerative Medicine (ECRRM), Cairo, Egypt., Abdel-Ghani GE; Department of Chemistry, Faculty of Science, Mansoura University, El-Gomhoria Street, Mansoura, ET-35516, Egypt.
Source: BMC biotechnology [BMC Biotechnol] 2025 Feb 06; Vol. 25 (1), pp. 15. Date of Electronic Publication: 2025 Feb 06.
Publication Type: Journal Article
Journal Info: Publisher: BioMed Central Country of Publication: England NLM ID: 101088663 Publication Model: Electronic Cited Medium: Internet ISSN: 1472-6750 (Electronic) Linking ISSN: 14726750 NLM ISO Abbreviation: BMC Biotechnol Subsets: MEDLINE
Database: MEDLINE Ultimate
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  Data: <searchLink fieldCode="AU" term="%22Abd-Elhalim+BT%22">Abd-Elhalim BT</searchLink>; Department of Agricultural Microbiology, Faculty of Agriculture, Ain Shams University, PO Box 68, Hadayek Shoubra, Shubra El-Khaimah, Cairo, 11241, Egypt. basma.talaat@agr.asu.edu.eg.<br /><searchLink fieldCode="AU" term="%22El-Bana+GG%22">El-Bana GG</searchLink>; Department of Chemistry, Faculty of Science, Mansoura University, El-Gomhoria Street, Mansoura, ET-35516, Egypt.; Mansoura University Student's Hospital, Mansoura University, El-Gomhoria Street, Mansoura, ET-35516, Egypt.<br /><searchLink fieldCode="AU" term="%22El-Sayed+AF%22">El-Sayed AF</searchLink>; Microbial Genetics Department, Biotechnology Research Institute, National Research Centre, Giza, Dokki, 12622, Egypt.; Egypt Center for Research and Regenerative Medicine (ECRRM), Cairo, Egypt.<br /><searchLink fieldCode="AU" term="%22Abdel-Ghani+GE%22">Abdel-Ghani GE</searchLink>; Department of Chemistry, Faculty of Science, Mansoura University, El-Gomhoria Street, Mansoura, ET-35516, Egypt.
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  Data: <searchLink fieldCode="JN" term="%22101088663%22">BMC biotechnology</searchLink> [BMC Biotechnol] 2025 Feb 06; Vol. 25 (1), pp. 15. <i>Date of Electronic Publication: </i>2025 Feb 06.
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  Data: <i>Publisher: </i><searchLink fieldCode="PB" term="%22BioMed+Central%22">BioMed Central </searchLink><i>Country of Publication: </i>England <i>NLM ID: </i>101088663 <i>Publication Model: </i>Electronic <i>Cited Medium: </i>Internet <i>ISSN: </i>1472-6750 (Electronic) <i>Linking ISSN: </i><searchLink fieldCode="IS" term="%2214726750%22">14726750 </searchLink><i>NLM ISO Abbreviation: </i>BMC Biotechnol <i>Subsets: </i>MEDLINE
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        Value: 10.1186/s12896-025-00948-8
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              Text: 2025 Feb 06
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