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Journal Abstract Search

699 related items for PubMed ID: 16848615

  • 21. Continuum molecular electrostatics, salt effects, and counterion binding--a review of the Poisson-Boltzmann theory and its modifications.
    Grochowski P, Trylska J.
    Biopolymers; 2008 Feb; 89(2):93-113. PubMed ID: 17969016
    [Abstract] [Full Text] [Related]

  • 22. Molecular origin of the negative heat capacity of hydrophilic hydration.
    Kinoshita M, Yoshidome T.
    J Chem Phys; 2009 Apr 14; 130(14):144705. PubMed ID: 19368463
    [Abstract] [Full Text] [Related]

  • 23. The SGB/NP hydration free energy model based on the surface generalized born solvent reaction field and novel nonpolar hydration free energy estimators.
    Gallicchio E, Zhang LY, Levy RM.
    J Comput Chem; 2002 Apr 15; 23(5):517-29. PubMed ID: 11948578
    [Abstract] [Full Text] [Related]

  • 24. Calculation of the hydration free energy difference between pyridine and its methyl-substituted derivatives by computer simulation methods.
    Partay L, Jedlovszky P, Jancsó G.
    J Phys Chem B; 2005 Apr 28; 109(16):8097-102. PubMed ID: 16851946
    [Abstract] [Full Text] [Related]

  • 25. Solvent-exposed backbone loosens the hydration shell of soluble folded proteins.
    Fernández A, Chen J, Crespo A.
    J Chem Phys; 2007 Jun 28; 126(24):245103. PubMed ID: 17614591
    [Abstract] [Full Text] [Related]

  • 26. Spatial decomposition of solvation free energy based on the 3D integral equation theory of molecular liquid: application to miniproteins.
    Yamazaki T, Kovalenko A.
    J Phys Chem B; 2011 Jan 20; 115(2):310-8. PubMed ID: 21166382
    [Abstract] [Full Text] [Related]

  • 27. Mosaic energy landscapes of liquids and the control of protein conformational dynamics by glass-forming solvents.
    Lubchenko V, Wolynes PG, Frauenfelder H.
    J Phys Chem B; 2005 Apr 21; 109(15):7488-99. PubMed ID: 16851860
    [Abstract] [Full Text] [Related]

  • 28. Solvation theory to provide a molecular interpretation of the hydrophobic entropy loss of noble-gas hydration.
    Irudayam SJ, Henchman RH.
    J Phys Condens Matter; 2010 Jul 21; 22(28):284108. PubMed ID: 21399280
    [Abstract] [Full Text] [Related]

  • 29. In silico prediction of drug solubility: 1. Free energy of hydration.
    Westergren J, Lindfors L, Höglund T, Lüder K, Nordholm S, Kjellander R.
    J Phys Chem B; 2007 Feb 22; 111(7):1872-82. PubMed ID: 17266351
    [Abstract] [Full Text] [Related]

  • 30. Hydrophobic potential of mean force as a solvation function for protein structure prediction.
    Lin MS, Fawzi NL, Head-Gordon T.
    Structure; 2007 Jun 22; 15(6):727-40. PubMed ID: 17562319
    [Abstract] [Full Text] [Related]

  • 31. Density functional theory of solvation and its relation to implicit solvent models.
    Ramirez R, Borgis D.
    J Phys Chem B; 2005 Apr 14; 109(14):6754-63. PubMed ID: 16851760
    [Abstract] [Full Text] [Related]

  • 32. MST continuum study of the hydration free energies of monovalent ionic species.
    Curutchet C, Bidon-Chanal A, Soteras I, Orozco M, Luque FJ.
    J Phys Chem B; 2005 Mar 03; 109(8):3565-74. PubMed ID: 16851394
    [Abstract] [Full Text] [Related]

  • 33. Hydration of hydrophobic solutes treated by the fundamental measure approach.
    Chuev GN, Sokolov VF.
    J Phys Chem B; 2006 Sep 21; 110(37):18496-503. PubMed ID: 16970477
    [Abstract] [Full Text] [Related]

  • 34. How the stabilization of INK4 tumor suppressor 3D structure evaluated by quantum chemical and molecular mechanics calculations corresponds well with experimental results: interplay of association enthalpy, entropy, and solvation effects.
    Otyepka M, Sklenovský P, Horinek D, Kubar T, Hobza P.
    J Phys Chem B; 2006 Mar 09; 110(9):4423-9. PubMed ID: 16509744
    [Abstract] [Full Text] [Related]

  • 35. Electrostatic polarization effects and hydrophobic hydration in ethanol-water solutions from molecular dynamics simulations.
    Zhong Y, Patel S.
    J Phys Chem B; 2009 Jan 22; 113(3):767-78. PubMed ID: 19115819
    [Abstract] [Full Text] [Related]

  • 36. On the molecular origins of volumetric data.
    Chalikian TV.
    J Phys Chem B; 2008 Jan 24; 112(3):911-7. PubMed ID: 18171052
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  • 37. Mechanisms of protein stabilization and prevention of protein aggregation by glycerol.
    Vagenende V, Yap MG, Trout BL.
    Biochemistry; 2009 Nov 24; 48(46):11084-96. PubMed ID: 19817484
    [Abstract] [Full Text] [Related]

  • 38. Thermodynamics of apoplastocyanin folding: comparison between experimental and theoretical results.
    Yoshidome T, Kinoshita M, Hirota S, Baden N, Terazima M.
    J Chem Phys; 2008 Jun 14; 128(22):225104. PubMed ID: 18554061
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  • 39. Absolute hydration free energy scale for alkali and halide ions established from simulations with a polarizable force field.
    Lamoureux G, Roux B.
    J Phys Chem B; 2006 Feb 23; 110(7):3308-22. PubMed ID: 16494345
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  • 40. Water structure and interactions with protein surfaces.
    Raschke TM.
    Curr Opin Struct Biol; 2006 Apr 23; 16(2):152-9. PubMed ID: 16546375
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