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PUBMED FOR HANDHELDS

Journal Abstract Search


538 related items for PubMed ID: 24116387

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  • 3. Impact of the CXCR4 structure on docking-based virtual screening of HIV entry inhibitors.
    Planesas JM, Pérez-Nueno VI, Borrell JI, Teixidó J.
    J Mol Graph Model; 2012 Sep; 38():123-36. PubMed ID: 23079643
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  • 6. Assessing an ensemble docking-based virtual screening strategy for kinase targets by considering protein flexibility.
    Tian S, Sun H, Pan P, Li D, Zhen X, Li Y, Hou T.
    J Chem Inf Model; 2014 Oct 27; 54(10):2664-79. PubMed ID: 25233367
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  • 7. Docking and MD study of histamine H4R based on the crystal structure of H1R.
    Feng Z, Hou T, Li Y.
    J Mol Graph Model; 2013 Feb 27; 39():1-12. PubMed ID: 23220277
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  • 8. Integrating ligand-based and protein-centric virtual screening of kinase inhibitors using ensembles of multiple protein kinase genes and conformations.
    Dixit A, Verkhivker GM.
    J Chem Inf Model; 2012 Oct 22; 52(10):2501-15. PubMed ID: 22992037
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  • 9. Structure-based virtual screening of MT2 melatonin receptor: influence of template choice and structural refinement.
    Pala D, Beuming T, Sherman W, Lodola A, Rivara S, Mor M.
    J Chem Inf Model; 2013 Apr 22; 53(4):821-35. PubMed ID: 23541165
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  • 10. From heptahelical bundle to hits from the Haystack: structure-based virtual screening for GPCR ligands.
    Kooistra AJ, Roumen L, Leurs R, de Esch IJ, de Graaf C.
    Methods Enzymol; 2013 Apr 22; 522():279-336. PubMed ID: 23374191
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  • 11. Performance of virtual screening against GPCR homology models: Impact of template selection and treatment of binding site plasticity.
    Jaiteh M, Rodríguez-Espigares I, Selent J, Carlsson J.
    PLoS Comput Biol; 2020 Mar 22; 16(3):e1007680. PubMed ID: 32168319
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  • 12. Insights into AT1 receptor activation through AngII binding studies.
    Matsoukas MT, Potamitis C, Plotas P, Androutsou ME, Agelis G, Matsoukas J, Zoumpoulakis P.
    J Chem Inf Model; 2013 Nov 25; 53(11):2798-811. PubMed ID: 24053563
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  • 14. Toward fully automated high performance computing drug discovery: a massively parallel virtual screening pipeline for docking and molecular mechanics/generalized Born surface area rescoring to improve enrichment.
    Zhang X, Wong SE, Lightstone FC.
    J Chem Inf Model; 2014 Jan 27; 54(1):324-37. PubMed ID: 24358939
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  • 16. A benchmarking study on virtual ligand screening against homology models of human GPCRs.
    Lim VJY, Du W, Chen YZ, Fan H.
    Proteins; 2018 Sep 27; 86(9):978-989. PubMed ID: 30051928
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  • 18. Dopamine D3 receptor antagonist reveals a cryptic pocket in aminergic GPCRs.
    Ferruz N, Doerr S, Vanase-Frawley MA, Zou Y, Chen X, Marr ES, Nelson RT, Kormos BL, Wager TT, Hou X, Villalobos A, Sciabola S, De Fabritiis G.
    Sci Rep; 2018 Jan 17; 8(1):897. PubMed ID: 29343833
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  • 19. Protein flexibility in ligand docking and virtual screening to protein kinases.
    Cavasotto CN, Abagyan RA.
    J Mol Biol; 2004 Mar 12; 337(1):209-25. PubMed ID: 15001363
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