These tools will no longer be maintained as of December 31, 2024. Archived website can be found here. PubMed4Hh GitHub repository can be found here. Contact NLM Customer Service if you have questions.


BIOMARKERS

Molecular Biopsy of Human Tumors

- a resource for Precision Medicine *

106 related articles for article (PubMed ID: 18020442)

  • 1. Cavitation free energy for organic molecules having various sizes and shapes.
    Grigoriev FV; Basilevsky MV; Gabin SN; Romanov AN; Sulimov VB
    J Phys Chem B; 2007 Dec; 111(49):13748-55. PubMed ID: 18020442
    [TBL] [Abstract][Full Text] [Related]  

  • 2. Computation of hydration free energies of organic solutes with an implicit water model.
    Basilevsky MV; Leontyev IV; Luschekina SV; Kondakova OA; Sulimov VB
    J Comput Chem; 2006 Apr; 27(5):552-70. PubMed ID: 16463371
    [TBL] [Abstract][Full Text] [Related]  

  • 3. Free energy of solvation from molecular dynamics simulation applying Voronoi-Delaunay triangulation to the cavity creation.
    Goncalves PF; Stassen H
    J Chem Phys; 2005 Dec; 123(21):214109. PubMed ID: 16356041
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Excluded volume effect for large and small solutes in water.
    Basilevsky MV; Grigoriev FV; Leontyev IV; Sulimov VB
    J Phys Chem A; 2005 Aug; 109(31):6939-46. PubMed ID: 16834052
    [TBL] [Abstract][Full Text] [Related]  

  • 5. Modeling the cavitation free energy.
    Floris FM
    J Phys Chem B; 2005 Dec; 109(50):24061-70. PubMed ID: 16375398
    [TBL] [Abstract][Full Text] [Related]  

  • 6. Computation of the contribution from the cavity effect to protein-ligand binding free energy.
    Grigoriev FV; Gabin SN; Romanov AN; Sulimov VB
    J Phys Chem B; 2008 Dec; 112(48):15355-60. PubMed ID: 18991438
    [TBL] [Abstract][Full Text] [Related]  

  • 7. 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; 111(7):1872-82. PubMed ID: 17266351
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Unraveling water's entropic mysteries: a unified view of nonpolar, polar, and ionic hydration.
    Ben-Amotz D; Underwood R
    Acc Chem Res; 2008 Aug; 41(8):957-67. PubMed ID: 18710198
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Building cavities in a fluid of spherical or rod-like particles: a contribution to the solvation free energy in isotropic and anisotropic polarizable continuum model.
    Benzi C; Cossi M; Improta R; Barone V
    J Comput Chem; 2005 Aug; 26(11):1096-105. PubMed ID: 15929089
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Excess densities and equimolar surfaces for spherical cavities in water.
    Floris FM
    J Chem Phys; 2007 Feb; 126(7):074505. PubMed ID: 17328618
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Universal solvation model based on solute electron density and on a continuum model of the solvent defined by the bulk dielectric constant and atomic surface tensions.
    Marenich AV; Cramer CJ; Truhlar DG
    J Phys Chem B; 2009 May; 113(18):6378-96. PubMed ID: 19366259
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Charge-dependent cavity radii for an accurate dielectric continuum model of solvation with emphasis on ions: aqueous solutes with oxo, hydroxo, amino, methyl, chloro, bromo, and fluoro functionalities.
    Ginovska B; Camaioni DM; Dupuis M; Schwerdtfeger CA; Gil Q
    J Phys Chem A; 2008 Oct; 112(42):10604-13. PubMed ID: 18816107
    [TBL] [Abstract][Full Text] [Related]  

  • 13. A classical point charge model study of system size dependence of oxidation and reorganization free energies in aqueous solution.
    Ayala R; Sprik M
    J Phys Chem B; 2008 Jan; 112(2):257-69. PubMed ID: 17994722
    [TBL] [Abstract][Full Text] [Related]  

  • 14. On the cavitation energy of water.
    Höfinger S; Zerbetto F
    Chemistry; 2003 Jan; 9(2):566-9. PubMed ID: 12532307
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Computing the free energy of molecular solids by the Einstein molecule approach: ices XIII and XIV, hard-dumbbells and a patchy model of proteins.
    Noya EG; Conde MM; Vega C
    J Chem Phys; 2008 Sep; 129(10):104704. PubMed ID: 19044935
    [TBL] [Abstract][Full Text] [Related]  

  • 16. In silico prediction of drug solubility: 2. Free energy of solvation in pure melts.
    Lüder K; Lindfors L; Westergren J; Nordholm S; Kjellander R
    J Phys Chem B; 2007 Feb; 111(7):1883-92. PubMed ID: 17266352
    [TBL] [Abstract][Full Text] [Related]  

  • 17. On the molecular origins of volumetric data.
    Chalikian TV
    J Phys Chem B; 2008 Jan; 112(3):911-7. PubMed ID: 18171052
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Improving the performance of the coupled reference interaction site model-hyper-netted chain (RISM-HNC)/simulation method for free energy of solvation.
    Freedman H; Le L; Tuszynski JA; Truong TN
    J Phys Chem B; 2008 Feb; 112(8):2340-8. PubMed ID: 18251537
    [TBL] [Abstract][Full Text] [Related]  

  • 19. Size dependence of cavity volume: a molecular dynamics study.
    Patel N; Dubins DN; Pomès R; Chalikian TV
    Biophys Chem; 2012 Feb; 161():46-9. PubMed ID: 22133917
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Solvation of a spherical cavity in simple liquids: interpolating between the limits.
    Wu J
    J Phys Chem B; 2009 May; 113(19):6813-8. PubMed ID: 19378961
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 6.