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Journal of Biomolecular Structure and Dynamics Volume 41, 2023 - Issue 6
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Research Articles

Synthesis, molecular docking, molecular dynamics and evaluation of Drug-Likeness properties of the fused N-Formyl pyrazoline substituted new dehydroepiandrosterone derivatives

İrfan Çapana Department of Material and Material Processing Technologies, Technical Sciences Vocational College, Gazi University, Ankara, TurkeyORCID Iconhttps://orcid.org/0000-0002-9555-1555View further author information
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Abdulmalik Shehub Department of Chemistry, Faculty of Science, Federal University Dutse, Dutse, Jigawa, NigeriaView further author information
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Yusuf Sertc Sorgun Vocational School, Yozgat Bozok University, Yozgat, TurkeyORCID Iconhttps://orcid.org/0000-0001-8836-8667View further author information
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İsmail Çelikd Department of Pharmaceutical Chemistry, Faculty of Pharmacy, Erciyes University, Kayseri, TurkeyORCID Iconhttps://orcid.org/0000-0002-8146-1663View further author information
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Meryem Erold Department of Pharmaceutical Chemistry, Faculty of Pharmacy, Erciyes University, Kayseri, TurkeyORCID Iconhttps://orcid.org/0000-0001-5676-098XView further author information
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İrfan Kocae Department of Chemistry, Faculty of Art & Sciences, Yozgat Bozok University, Yozgat, TurkeyORCID Iconhttps://orcid.org/0000-0001-7873-159XView further author information
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Süleyman Servif Department of Chemistry, Faculty of Science, Fırat University, Elazığ, TurkeyCorrespondence[email protected]
ORCID Iconhttps://orcid.org/0000-0003-0827-8624View further author information
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Pages 2492-2503 | Received 30 May 2021, Accepted 21 Jan 2022, Published online: 08 Feb 2022

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Arivazhagan R, Sridevi C, Prakasam A & Kumar R. (2023) Spectroscopic and Molecular Docking Studies of a Novel Biologically Active Heterocyclic Compound 2-Chloro-6-Methoxypyridine-4-Carboxylic Acid by Quantum Computational Method. Polycyclic Aromatic Compounds 43:6, pages 5404-5436.
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Articles from other publishers (3)

Gökay Çetiner, Ulviye Acar Çevik, Ismail Celik, Hayrani Eren Bostancı, Yusuf Özkay & Zafer Asım Kaplancıklı. (2023) New imidazole derivatives as aromatase inhibitor: Design, synthesis, biological activity, molecular docking, and computational ADME-Tox studies. Journal of Molecular Structure 1278, pages 134920.
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Jin-Bu Xu, Jin Bi, Peng Wen, Shi-Xing Miao, Xiao-Huan Li & Feng Gao. (2023) Synthesis and Cytotoxicity Evaluation of Dehydroepiandrosterone Derivatives by Iron-catalyzed Stereoselective Hydroamination. Chemical and Pharmaceutical Bulletin.
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Serena Vittorio, Candida Manelfi, Silvia Gervasoni, Andrea R. Beccari, Alessandro Pedretti, Giulio Vistoli & Carmine Talarico. (2022) Computational Insights into the Sequence-Activity Relationships of the NGF(1–14) Peptide by Molecular Dynamics Simulations. Cells 11:18, pages 2808.
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