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 *

105 related articles for article (PubMed ID: 21792439)

  • 1. Understanding microsolvation of Li+: structural and energetical analyses.
    Romero J; Reyes A; David J; Restrepo A
    Phys Chem Chem Phys; 2011 Sep; 13(33):15264-71. PubMed ID: 21792439
    [TBL] [Abstract][Full Text] [Related]  

  • 2. Microscopic solvation of a lithium atom in water-ammonia mixed clusters: solvent coordination and electron localization in presence of a counterion.
    Pratihar S; Chandra A
    J Chem Phys; 2008 Jul; 129(2):024511. PubMed ID: 18624542
    [TBL] [Abstract][Full Text] [Related]  

  • 3. Low-lying structures and stabilities of large water clusters: investigation based on the combination of the AMOEBA potential and generalized energy-based fragmentation approach.
    Yang Z; Hua S; Hua W; Li S
    J Phys Chem A; 2010 Sep; 114(34):9253-61. PubMed ID: 20669931
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Experimental and theoretical study of the microsolvation of sodium atoms in methanol clusters: differences and similarities to sodium-water and sodium-ammonia.
    Dauster I; Suhm MA; Buck U; Zeuch T
    Phys Chem Chem Phys; 2008 Jan; 10(1):83-95. PubMed ID: 18075686
    [TBL] [Abstract][Full Text] [Related]  

  • 5. Microsolvation of Mg²⁺, Ca²⁺: strong influence of formal charges in hydrogen bond networks.
    Gonzalez JD; Florez E; Romero J; Reyes A; Restrepo A
    J Mol Model; 2013 Apr; 19(4):1763-77. PubMed ID: 23306735
    [TBL] [Abstract][Full Text] [Related]  

  • 6. A first principles molecular dynamics study of excess electron and lithium atom solvation in water-ammonia mixed clusters: structural, spectral, and dynamical behaviors of [(H2O)5NH3]- and Li(H2O)5NH3 at finite temperature.
    Pratihar S; Chandra A
    J Chem Phys; 2011 Jan; 134(3):034302. PubMed ID: 21261348
    [TBL] [Abstract][Full Text] [Related]  

  • 7. H·(H2O)n clusters: microsolvation of the hydrogen atom via molecular ab initio gradient embedded genetic algorithm (GEGA).
    Alexandrova AN
    J Phys Chem A; 2010 Dec; 114(48):12591-9. PubMed ID: 21077611
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Structures of hydrated Li+-thymine and Li+-uracil complexes by IRMPD spectroscopy in the N-H/O-H stretching region.
    Gillis EA; Rajabi K; Fridgen TD
    J Phys Chem A; 2009 Feb; 113(5):824-32. PubMed ID: 19175333
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Microsolvation of the sodium and iodide ions and their ion pair in acetonitrile clusters: a theoretical study.
    Nguyen TN; Hughes SR; Peslherbe GH
    J Phys Chem B; 2008 Jan; 112(2):621-35. PubMed ID: 18183958
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Microhydration of the selenite dianion: a theoretical study of structures, hydration energies, and electronic stabilities of SeO(3)(2-)(H(2)O)(n) (n = 0-6, 9) clusters.
    Wicke H; Meleshyn A
    J Phys Chem A; 2010 Sep; 114(34):8948-60. PubMed ID: 20690659
    [TBL] [Abstract][Full Text] [Related]  

  • 11. An ab initio study of microsolvation of LiF in water: structures and properties of LiF-Wn, n = 1-9 complexes.
    Upadhyay DM; Mishra PC
    J Comput Chem; 2003 Aug; 24(11):1336-47. PubMed ID: 12827675
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Excess electron and lithium atom solvation in water clusters at finite temperature: an ab initio molecular dynamics study of the structural, spectral, and dynamical behavior of (H2O)6- and Li(H2O)6.
    Pratihar S; Chandra A
    J Phys Chem A; 2010 Nov; 114(44):11869-78. PubMed ID: 20958010
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Ab initio studies on the mechanism of the size-dependent hydrogen-loss reaction in Mg+(H2O)n.
    Siu CK; Liu ZF
    Chemistry; 2002 Jul; 8(14):3177-86. PubMed ID: 12203347
    [TBL] [Abstract][Full Text] [Related]  

  • 14. A study of N-methylacetamide in water clusters: based on atom-bond electronegativity equalization method fused into molecular mechanics.
    Yang ZZ; Qian P
    J Chem Phys; 2006 Aug; 125(6):64311. PubMed ID: 16942290
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Treatment of dilute clusters of methanol and water by ab initio quantum mechanical calculations.
    Ruckenstein E; Shulgin IL; Tilson JL
    J Phys Chem A; 2005 Feb; 109(5):807-15. PubMed ID: 16838951
    [TBL] [Abstract][Full Text] [Related]  

  • 16. The nature of the chemical bond revisited: an energy-partitioning analysis of nonpolar bonds.
    Kovács A; Esterhuysen C; Frenking G
    Chemistry; 2005 Mar; 11(6):1813-25. PubMed ID: 15672434
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Structural characterization of the (methanol)4 potential energy surface.
    David J; Guerra D; Restrepo A
    J Phys Chem A; 2009 Sep; 113(38):10167-73. PubMed ID: 19711934
    [TBL] [Abstract][Full Text] [Related]  

  • 18. On the unusual properties of halogen bonds: a detailed ab initio study of X2-(H2O)(1-5) clusters (X = Cl and Br).
    Bernal-Uruchurtu MI; Hernández-Lamoneda R; Janda KC
    J Phys Chem A; 2009 May; 113(19):5496-505. PubMed ID: 19368400
    [TBL] [Abstract][Full Text] [Related]  

  • 19. Microsolvation of methyl hydrogen peroxide: ab initio quantum chemical approach.
    Kulkarni AD; Rai D; Bartolotti LJ; Pathak RK
    J Chem Phys; 2009 Aug; 131(5):054310. PubMed ID: 19673565
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Effects of microsolvation on the adenine-uracil base pair and its radical anion: adenine-uracil mono- and dihydrates.
    Kim S; Schaefer HF
    J Phys Chem A; 2007 Oct; 111(41):10381-9. PubMed ID: 17705454
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 6.