يعرض 71 - 80 نتائج من 155,109 نتيجة بحث عن '"docking"', وقت الاستعلام: 1.82s تنقيح النتائج
  1. 71
    دورية أكاديمية
    Semi-coordination Cu–O bond on a copper complex featuring O,O-donor ligand as potential antibacterial agent: green synthesis, characterization, DFT, in-silico ADMET profiling and molecular docking studies.

    المؤلفون: Syaima, Husna1 (AUTHOR), Prasetyo, Wahyu Eko2 (AUTHOR), Rahardjo, Sentot Budi3 (AUTHOR) sentotbr@staff.uns.ac.id, Suryanti, Venty3 (AUTHOR)

    المصدر: Structural Chemistry. Jun2024, Vol. 35 Issue 3, p721-737. 17p.

    مصطلحات موضوعية: *COPPER compounds, *MOLECULAR docking, *ANTIBACTERIAL agents, *MOLAR conductivity, *SALMONELLA typhi, *COPOLYMERS


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  2. 72
    دورية أكاديمية
    Effect of Silver-Graphene Oxide-Cobalt Oxide Nanocomposite on Cytotoxic Levels in MRC-5 and HepG2 Cell Lines and Molecular Docking Studies.

    المؤلفون: Ilikci-Sagkan, Rahsan1 (AUTHOR), Istifli, Erman Salih2 (AUTHOR), Liman, Recep3 (AUTHOR), Atacan, Keziban4 (AUTHOR), Bas, Salih Zeki5 (AUTHOR), Ozmen, Mustafa5 (AUTHOR) musozmen@gmail.com

    المصدر: Journal of Cluster Science. Jun2024, Vol. 35 Issue 5, p1481-1491. 11p.

    مصطلحات موضوعية: *MOLECULAR docking, *CELL lines, *NANOCOMPOSITE materials, *COBALT oxides, *CYTOTOXINS, *SILVER, *MOLECULAR recognition


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  3. 73
    دورية أكاديمية
    Chemical composition of leaf essential oil of Schinopsis lorentzii and its inhibitory effects against key enzymes relevant to type-2 diabetes: an emphasis on GC-MS chemical profiling and molecular docking studies.

    المؤلفون: El-Nashar, Heba A. S.1 (AUTHOR) heba_pharma@pharma.asu.edu.eg, Shabana, El-Shaimaa2 (AUTHOR), Kamli, Hossam3 (AUTHOR), Shaikh, Ahmad3 (AUTHOR), Adel, Mai4 (AUTHOR)

    المصدر: Journal of Essential Oil-Bearing Plants. Jun2024, Vol. 27 Issue 3, p731-743. 13p.

    مصطلحات موضوعية: *ESSENTIAL oils, *MOLECULAR docking, *TYPE 2 diabetes, *COMPOSITION of leaves, *GAS chromatography/Mass spectrometry (GC-MS), *CARYOPHYLLENE, *TERPENES

    مصطلحات جغرافية: BOLIVIA, PARAGUAY, ARGENTINA


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  4. 74
    دورية أكاديمية
    Chemical profile, anticholinesterase and molecular docking studies of Boesenbergia albosanguinea (Ridl.) Loes. essential oil.

    المؤلفون: Ngalang, Michael Drick1 (AUTHOR), Salleh, Wan Mohd Nuzul Hakimi Wan1 (AUTHOR) wmnhakimi@fsmt.upsi.edu.my, Salihu, Abubakar Siddiq1,2 (AUTHOR), Ab Ghani, Nurunajah3,4 (AUTHOR)

    المصدر: Journal of Essential Oil-Bearing Plants. Jun2024, Vol. 27 Issue 3, p693-700. 8p.

    مصطلحات موضوعية: *ESSENTIAL oils, *MOLECULAR docking, *ACETYLCHOLINESTERASE, *AMINO acid residues, *GAS chromatography, *BUTYRYLCHOLINESTERASE


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  5. 75
    دورية أكاديمية
    Antileishmanial activity of essential oil from a high-altitude herb, Heracleum pinnatum: an in vitro and in silico analysis.

    المؤلفون: Chuskit, Rigzin1 (AUTHOR), Joshi, Jyoti2 (AUTHOR), Gupta, Ipsa1 (AUTHOR), Bandral, Chetna3 (AUTHOR), Kaur, Shalinder1 (AUTHOR) shalinder@pu.ac.in, Kaur, Sukhbir3 (AUTHOR), Batish, Daizy Rani1 (AUTHOR), Singh, Harminder Pal4 (AUTHOR)

    المصدر: Journal of Essential Oil-Bearing Plants. Jun2024, Vol. 27 Issue 3, p818-837. 20p.

    مصطلحات موضوعية: *ESSENTIAL oils, *MOLECULAR docking, *LEISHMANIA donovani, *TRADITIONAL medicine, *HERBS, *TERPENES


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  6. 76
    دورية أكاديمية
    Role of CSF1R 550th-tryptophan in kusunokinin and CSF1R inhibitor binding and ligand-induced structural effect.

    المؤلفون: Chompunud Na Ayudhya, Chompunud1 (AUTHOR), Graidist, Potchanapond1,2 (AUTHOR), Tipmanee, Varomyalin1,2 (AUTHOR) tvaromya@medicine.psu.ac.th

    المصدر: Scientific Reports. 5/31/2024, Vol. 14 Issue 1, p1-18. 18p.

    مصطلحات موضوعية: *LIGAND binding (Biochemistry), *MOLECULAR docking, *BINDING sites, *LIGANDS (Chemistry), *BOUND states, *DRUG design, *TRYPTOPHAN

    النص الكامل

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  7. 77
    دورية أكاديمية
    Exploring the Antiproliferative Potential of Morpholine‐Functionalized Aurones: Design, Synthesis, SAR, DFT, Hirshfeld Surface, 3D Energy Frameworks and Molecular Docking Analysis.

    المؤلفون: Kumar, Gourav1,2 (AUTHOR) gouravbura1994@gmail.com, Saroha, Bhavna1 (AUTHOR), Kumari, Bavita1 (AUTHOR), Ghosh, Sushmita3 (AUTHOR), Nassare, Vilas D.3 (AUTHOR), Kumar, Suresh1 (AUTHOR) suresh_dua47@rediffmail.com

    المصدر: ChemistrySelect. May2024, Vol. 9 Issue 20, p1-19. 19p.

    مصطلحات موضوعية: *AURONES, *MOLECULAR docking, *MOLECULAR hybridization, *DIMENSIONAL analysis, *STRUCTURE-activity relationships


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  8. 78
    دورية أكاديمية
    Identification of Molecular Mechanisms of Ameloblastoma and Drug Repositioning by Integration of Bioinformatics Analysis and Molecular Docking Simulation.

    المؤلفون: Chujan, Suthipong1,2 (AUTHOR), Vajeethaveesin, Nutsira3 (AUTHOR), Satayavivad, Jutamaad1,2 (AUTHOR) jutamaad@cri.or.th, Kitkumthorn, Nakarin4 (AUTHOR) nakarinkit@gmail.com

    المصدر: Bioinformatics & Biology Insights. 5/28/2024, p1-10. 10p.

    مصطلحات موضوعية: *DRUG repositioning, *MOLECULAR docking, *AMELOBLASTOMA, *BIOINFORMATICS, *GENE ontology, *IDENTIFICATION, *BIOINFORMATICS software

    النص الكامل

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  9. 79
    دورية أكاديمية
    Bioinformatics approach for structure modeling, vaccine design, and molecular docking of Brucella candidate proteins BvrR, OMP25, and OMP31.

    المؤلفون: Elrashedy, Alyaa1 (AUTHOR) Alyaa.elrashedy.ms@vet.usc.edu.eg, Nayel, Mohamed1 (AUTHOR), Salama, Akram1 (AUTHOR), Salama, Mohammed M.2 (AUTHOR), Hasan, Mohamed E.3 (AUTHOR)

    المصدر: Scientific Reports. 5/25/2024, p1-31. 31p.

    مصطلحات موضوعية: *MOLECULAR docking, *STRUCTURAL bioinformatics, *CYTOTOXIC T cells, *T cells, *BRUCELLA, *ZOONOSES

    النص الكامل

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  10. 80
    دورية أكاديمية
    Synthesis, Binding and Docking Studies of Indole‐1,3,4‐Thiadiazole Derivatives As Potent Α‐Amylase and Lox Inhibitors.

    المؤلفون: Doddagaddavalli, Manasa A.1 (AUTHOR), Katrahalli, Umesha2 (AUTHOR), Joshi, Shrinivas D.3 (AUTHOR), Seetharamappa, J.1 (AUTHOR) drjseetharamappa@kud.ac.in

    المصدر: ChemistrySelect. 5/21/2024, Vol. 9 Issue 19, p1-17. 17p.

    مصطلحات موضوعية: *MOLECULAR docking, *SERUM albumin, *CARRIER proteins, *AMINO acid residues, *CIRCULAR dichroism, *ANTI-inflammatory agents


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