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PUBMED FOR HANDHELDS

Journal Abstract Search


487 related items for PubMed ID: 19354203

  • 61. Automated molecular library generation of proteic fragments by virtual proteolysis for molecular modelling studies.
    Librando V, Gullotto D, Minniti Z.
    In Silico Biol; 2006; 6(5):449-57. PubMed ID: 17274772
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  • 62. CLEVER: pipeline for designing in silico chemical libraries.
    Song CM, Bernardo PH, Chai CL, Tong JC.
    J Mol Graph Model; 2009 Jan; 27(5):578-83. PubMed ID: 18986817
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  • 63. Ligand mapping on protein surfaces by the 3D-RISM theory: toward computational fragment-based drug design.
    Imai T, Oda K, Kovalenko A, Hirata F, Kidera A.
    J Am Chem Soc; 2009 Sep 02; 131(34):12430-40. PubMed ID: 19655800
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  • 64. Concept of combinatorial de novo design of drug-like molecules by particle swarm optimization.
    Hartenfeller M, Proschak E, Schüller A, Schneider G.
    Chem Biol Drug Des; 2008 Jul 02; 72(1):16-26. PubMed ID: 18564216
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  • 65. Deconstructing fragment-based inhibitor discovery.
    Babaoglu K, Shoichet BK.
    Nat Chem Biol; 2006 Dec 02; 2(12):720-3. PubMed ID: 17072304
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  • 66. Binding estimation after refinement, a new automated procedure for the refinement and rescoring of docked ligands in virtual screening.
    Rastelli G, Degliesposti G, Del Rio A, Sgobba M.
    Chem Biol Drug Des; 2009 Mar 02; 73(3):283-6. PubMed ID: 19207463
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  • 67. Evaluation of 3-carboxy-4(1H)-quinolones as inhibitors of human protein kinase CK2.
    Golub AG, Yakovenko OY, Bdzhola VG, Sapelkin VM, Zien P, Yarmoluk SM.
    J Med Chem; 2006 Nov 02; 49(22):6443-50. PubMed ID: 17064064
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  • 68. Selection of in silico drug screening results for G-protein-coupled receptors by using universal active probes.
    Wada M, Kanamori E, Nakamura H, Fukunishi Y.
    J Chem Inf Model; 2011 Sep 26; 51(9):2398-407. PubMed ID: 21848279
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  • 69. The challenge of predicting drug toxicity in silico.
    Vedani A, Dobler M, Lill MA.
    Basic Clin Pharmacol Toxicol; 2006 Sep 26; 99(3):195-208. PubMed ID: 16930291
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  • 70. Discovery of new inhibitors of D-alanine:D-alanine ligase by structure-based virtual screening.
    Kovac A, Konc J, Vehar B, Bostock JM, Chopra I, Janezic D, Gobec S.
    J Med Chem; 2008 Dec 11; 51(23):7442-8. PubMed ID: 19053785
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  • 71. Identification of novel protein kinase CK1 delta (CK1delta) inhibitors through structure-based virtual screening.
    Cozza G, Gianoncelli A, Montopoli M, Caparrotta L, Venerando A, Meggio F, Pinna LA, Zagotto G, Moro S.
    Bioorg Med Chem Lett; 2008 Oct 15; 18(20):5672-5. PubMed ID: 18799313
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  • 72. SVM model for virtual screening of Lck inhibitors.
    Liew CY, Ma XH, Liu X, Yap CW.
    J Chem Inf Model; 2009 Apr 15; 49(4):877-85. PubMed ID: 19267483
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  • 73. Computer-aided design and synthesis of nonpeptidic plasmepsin II and IV inhibitors.
    Luksch T, Chan NS, Brass S, Sotriffer CA, Klebe G, Diederich WE.
    ChemMedChem; 2008 Sep 15; 3(9):1323-36. PubMed ID: 18752222
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  • 74. Flaviviral protease inhibitors identified by fragment-based library docking into a structure generated by molecular dynamics.
    Ekonomiuk D, Su XC, Ozawa K, Bodenreider C, Lim SP, Otting G, Huang D, Caflisch A.
    J Med Chem; 2009 Aug 13; 52(15):4860-8. PubMed ID: 19572550
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  • 75. Fragment-based drug design: combining philosophy with technology.
    Bartoli S, Fincham CI, Fattori D.
    Curr Opin Drug Discov Devel; 2007 Jul 13; 10(4):422-9. PubMed ID: 17659483
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  • 76. NMR fragment screening: tackling protein-protein interaction targets.
    Schade M, Oschkinat H.
    Curr Opin Drug Discov Devel; 2005 May 13; 8(3):365-73. PubMed ID: 15892252
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  • 77. Classification of chemical compounds by protein-compound docking for use in designing a focused library.
    Fukunishi Y, Mikami Y, Takedomi K, Yamanouchi M, Shima H, Nakamura H.
    J Med Chem; 2006 Jan 26; 49(2):523-33. PubMed ID: 16420039
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  • 78. Efficient discovery of inhibitory ligands for diverse targets from a small combinatorial chemical library of chimeric molecules.
    Thorpe DS, Edith Chan AW, Binnie A, Chen LC, Robinson A, Spoonamore J, Rodwell D, Wade S, Wilson S, Ackerman-Berrier M, Yeoman H, Walle S, Wu Q, Wertman KF.
    Biochem Biophys Res Commun; 1999 Dec 09; 266(1):62-5. PubMed ID: 10581165
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  • 79. In silico multi-filter screening approaches for developing novel beta-secretase inhibitors.
    Fujimoto T, Matsushita Y, Gouda H, Yamaotsu N, Hirono S.
    Bioorg Med Chem Lett; 2008 May 01; 18(9):2771-5. PubMed ID: 18434150
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  • 80. Using computational techniques in fragment-based drug discovery.
    Desjarlais RL.
    Methods Enzymol; 2011 May 01; 493():137-55. PubMed ID: 21371590
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