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Journal Abstract Search

488 related items for PubMed ID: 27585602

  • 1. Design of Novel Chemotherapeutic Agents Targeting Checkpoint Kinase 1 Using 3D-QSAR Modeling and Molecular Docking Methods.
    Balupuri A, Balasubramanian PK, Cho SJ.
    Curr Comput Aided Drug Des; 2016; 12(4):302-313. PubMed ID: 27585602
    [Abstract] [Full Text] [Related]

  • 2. Docking-based 3D-QSAR study of pyridyl aminothiazole derivatives as checkpoint kinase 1 inhibitors.
    Balupuri A, Balasubramanian PK, Gadhe CG, Cho SJ.
    SAR QSAR Environ Res; 2014; 25(8):651-71. PubMed ID: 24911214
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  • 3. In Silico Exploration of 1,7-Diazacarbazole Analogs as Checkpoint Kinase 1 Inhibitors by Using 3D QSAR, Molecular Docking Study, and Molecular Dynamics Simulations.
    Gao X, Han L, Ren Y.
    Molecules; 2016 May 05; 21(5):. PubMed ID: 27164065
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  • 4. 3D-QSAR study of Chk1 kinase inhibitors based on docking.
    Zhao L, Liu Y, Hu S, Zhang H.
    J Mol Model; 2012 Aug 05; 18(8):3669-94. PubMed ID: 22367634
    [Abstract] [Full Text] [Related]

  • 5. 3D-QSAR, molecular dynamics simulations, and molecular docking studies on pyridoaminotropanes and tetrahydroquinazoline as mTOR inhibitors.
    Chaube U, Bhatt H.
    Mol Divers; 2017 Aug 05; 21(3):741-759. PubMed ID: 28577112
    [Abstract] [Full Text] [Related]

  • 6. Molecular Modeling Studies on Carbazole Carboxamide Based BTK Inhibitors Using Docking and Structure-Based 3D-QSAR.
    Li R, Du Y, Gao Z, Shen J.
    Int J Mol Sci; 2018 Apr 19; 19(4):. PubMed ID: 29671827
    [Abstract] [Full Text] [Related]

  • 7. Combined 3D-QSAR and Docking Modelling Study on Indolocarbazole Series Compounds as Tie-2 Inhibitors.
    Tian Y, Xu J, Li Z, Zhu Z, Zhang J, Wu S.
    Int J Mol Sci; 2011 Apr 19; 12(8):5080-97. PubMed ID: 21954347
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  • 8. Structure-based quantitative structure-activity relationship studies of checkpoint kinase 1 inhibitors.
    Du J, Xi L, Lei B, Lu J, Li J, Liu H, Yao X.
    J Comput Chem; 2010 Nov 30; 31(15):2783-93. PubMed ID: 20839304
    [Abstract] [Full Text] [Related]

  • 9. Molecular Modeling Study for the Design of Novel Peroxisome Proliferator-Activated Receptor Gamma Agonists using 3D-QSAR and Molecular Docking.
    Jian Y, He Y, Yang J, Han W, Zhai X, Zhao Y, Li Y.
    Int J Mol Sci; 2018 Feb 23; 19(2):. PubMed ID: 29473866
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  • 11. CoMFA and CoMSIA 3D QSAR and docking studies on conformationally-restrained cinnamoyl HIV-1 integrase inhibitors: exploration of a binding mode at the active site.
    Buolamwini JK, Assefa H.
    J Med Chem; 2002 Feb 14; 45(4):841-52. PubMed ID: 11831895
    [Abstract] [Full Text] [Related]

  • 12. QSAR and molecular docking studies on oxindole derivatives as VEGFR-2 tyrosine kinase inhibitors.
    Kang CM, Liu DQ, Zhao XH, Dai YJ, Cheng JG, Lv YT.
    J Recept Signal Transduct Res; 2016 Feb 14; 36(1):103-9. PubMed ID: 26416217
    [Abstract] [Full Text] [Related]

  • 13. CoMFA, CoMSIA, Topomer CoMFA, HQSAR, molecular docking and molecular dynamics simulations study of triazine morpholino derivatives as mTOR inhibitors for the treatment of breast cancer.
    Chhatbar DM, Chaube UJ, Vyas VK, Bhatt HG.
    Comput Biol Chem; 2019 Jun 14; 80():351-363. PubMed ID: 31085426
    [Abstract] [Full Text] [Related]

  • 14. Computational investigation of imidazo[2,1-b]oxazole derivatives as potential mutant BRAF kinase inhibitors: 3D-QSAR, molecular docking, molecular dynamics simulation, and ADMETox studies.
    Boutalaka M, El Bahi S, Alaqarbeh M, El Alaouy MA, Koubi Y, Khatabi KE, Maghat H, Bouachrine M, Lakhlifi T.
    J Biomol Struct Dyn; 2024 Jul 14; 42(10):5268-5287. PubMed ID: 37424193
    [Abstract] [Full Text] [Related]

  • 15. Molecular docking and 3D-QSAR study on 4-(1H-indazol-4-yl) phenylamino and aminopyrazolopyridine urea derivatives as kinase insert domain receptor (KDR) inhibitors.
    Wu X, Wu S, Chen WH.
    J Mol Model; 2012 Mar 14; 18(3):1207-18. PubMed ID: 21695506
    [Abstract] [Full Text] [Related]

  • 16. 3D-QSAR analysis on ATR protein kinase inhibitors using CoMFA and CoMSIA.
    Li X, Shu M, Wang Y, Yu R, Yao S, Lin Z.
    Curr Comput Aided Drug Des; 2014 Mar 14; 10(4):327-34. PubMed ID: 25994639
    [Abstract] [Full Text] [Related]

  • 17. Molecular modeling-driven approach for identification of Janus kinase 1 inhibitors through 3D-QSAR, docking and molecular dynamics simulations.
    Itteboina R, Ballu S, Sivan SK, Manga V.
    J Recept Signal Transduct Res; 2017 Oct 14; 37(5):453-469. PubMed ID: 28537140
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