يعرض 1 - 10 نتائج من 530 نتيجة بحث عن '"HQSAR"', وقت الاستعلام: 0.93s تنقيح النتائج
  1. 1
    دورية أكاديمية
    Computational integration for antifungal 1,2,4-triazole inhibitors design: QSAR, molecular docking, molecular dynamics simulations, ADME/Tox, and retrosynthesis studies

    المؤلفون: Soukaina Bouamrane, Ayoub Khaldan, Marwa Alaqarbeh, Abdelouahid Sbai, Mohammed Aziz Ajana, Tahar Lakhlifi, Mohammed Bouachrine, Hamid Maghat

    المصدر: Chemical Physics Impact, Vol 8, Iss , Pp 100502- (2024)

    مصطلحات موضوعية: CoMFA, CoMSIA, HQSAR, Lipinski's rule, Protein–ligand interaction, Physics, QC1-999, Chemistry, QD1-999

    وصف الملف: electronic resource

    Relation: http://www.sciencedirect.com/science/article/pii/S266702242400046X; https://doaj.org/toc/2667-0224

    URL الوصول: https://doaj.org/article/ed52f1aba3dd48468596591a87199319

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  2. 2
    دورية أكاديمية
    Exploring structural requirements of simple benzene derivatives for adsorption on carbon nanotubes: CoMFA, GRIND, and HQSAR

    المؤلفون: Mansouri, Forough, Sarlak, NahidAff1, IDs11224022019735_cor2

    المصدر: Structural Chemistry: Computational and Experimental Studies of Chemical and Biological Systems. 34(2):413-424

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  3. 3
    دورية أكاديمية
    HQSAR, CoMFA, CoMSIA Docking Studies and Simulation MD on Quinazolines/Quinolines Derivatives for DENV Virus Inhibitory Activity

    المؤلفون: Tabti, Kamal, Elmchichi, Larbi, Sbai, AbdelouahidAff1, IDs42250022004844_cor3, Maghat, Hamid, Bouachrine, MohammedAff1, Aff2, Lakhlifi, Tahar

    المصدر: Chemistry Africa: A Journal of the Tunisian Chemical Society. 5(6):1937-1958

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  4. 4
    دورية أكاديمية
    The importance of good practices and false hits for QSAR-driven virtual screening real application: a SARS-CoV-2 main protease (Mpro) case study

    المؤلفون: Mateus Sá Magalhães Serafim, Simone Queiroz Pantaleão, Elany Barbosa da Silva, James H. McKerrow, Anthony J. O’Donoghue, Bruno Eduardo Fernandes Mota, Kathia Maria Honorio, Vinícius Gonçalves Maltarollo

    المصدر: Frontiers in Drug Discovery, Vol 3 (2023)

    مصطلحات موضوعية: enzymatic inhibition, HQSAR, Mpro, QSAR, SARS-CoV-2, Therapeutics. Pharmacology, RM1-950

    وصف الملف: electronic resource

    Relation: https://www.frontiersin.org/articles/10.3389/fddsv.2023.1237655/full; https://doaj.org/toc/2674-0338

    URL الوصول: https://doaj.org/article/e2db8cf43a7740b480f9cbd0085bc576

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  5. 5
    دورية أكاديمية
    QSAR analysis of 3-pyrimidin-4-yl-oxazolidin-2-one derivatives isocitrate dehydrogenase inhibitors using Topomer CoMFA and HQSAR methods

    المؤلفون: Tong, Jian-BoAff1, Aff2, IDs11030021102226_cor1, Bian, ShuaiAff1, Aff2, Zhang, XingAff1, Aff2, Luo, DingAff1, Aff2

    المصدر: Molecular Diversity. 26(2):1017-1037

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  6. 6
    دورية أكاديمية

    لا يتم عرض هذه النتيجة على الضيوف.

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  7. 7
    دورية أكاديمية
    6-amide-2-aryl benzoxazole/benzimidazole derivatives as VEFGR-2 inhibitors in two-and three-dimensional QSAR studies: topomer CoMFA and HQSAR

    المؤلفون: Tong, Jian-BoAff1, Aff2, IDs1169602101588w_cor1, Feng, YiAff1, Aff2, Luo, DingAff1, Aff2, Wang, Tian-HaoAff1, Aff2

    المصدر: Chemical Papers. 75(7):3551-3562

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  8. 8
    دورية أكاديمية
    Design of novel SHP2 inhibitors using Topomer CoMFA, HQSAR analysis, and molecular docking

    المؤلفون: Tong, Jian-BoAff1, Aff2, Luo, DingAff1, Aff2, Zhang, XingAff1, Aff2, Bian, ShuaiAff1, Aff2

    المصدر: Structural Chemistry: Computational and Experimental Studies of Chemical and Biological Systems. 32(3):1061-1076

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  9. 9
    دورية أكاديمية
    Cytotoxic Activities and QSAR Studies of Diterpenoid Isosteviol Derivatives as Anti-Esophageal Agents

    المؤلفون: Cong-Jun LiuAff1, Aff2, Wang, Yu-Fei, Yao, Jian-Hua, Liu, Yan-Ping, Jiang, Qiao-Juan, Liu, Pan-Ping

    المصدر: Russian Journal of Bioorganic Chemistry. 47(1):288-298

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  10. 10
    دورية أكاديمية
    New molecular insights into dual inhibitors of tankyrase as Wnt signaling antagonists: 3D-QSAR studies on 4H-1,2,4-triazole derivatives for the design of novel anticancer agents

    المؤلفون: Mehta, Chirag C., Patel, Ankitkumar, Bhatt, Hardik G.Aff1

    المصدر: Structural Chemistry: Computational and Experimental Studies of Chemical and Biological Systems. 31(6):2371-2389

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