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 *

165 related articles for article (PubMed ID: 16854032)

  • 21. Thermodynamic study of proton transfer reactions of Re(V) trans-dioxocomplexes in aqueous solution.
    Gancheff JS; Kremer C; Denis PA; Giorgi C; Bianchi A
    Dalton Trans; 2009 Oct; (39):8257-68. PubMed ID: 19789778
    [TBL] [Abstract][Full Text] [Related]  

  • 22. Applicability of hybrid density functional theory methods to calculation of molecular hyperpolarizability.
    Suponitsky KY; Tafur S; Masunov AE
    J Chem Phys; 2008 Jul; 129(4):044109. PubMed ID: 18681636
    [TBL] [Abstract][Full Text] [Related]  

  • 23. Ab-initio and density functional study of L- and D-forms of alanine and serine in gas phase and bulk aqueous medium.
    Upadhyay DM; Rai AK; Rai DK; Singh AN; Kumar A
    Spectrochim Acta A Mol Biomol Spectrosc; 2007 Apr; 66(4-5):909-18. PubMed ID: 16872882
    [TBL] [Abstract][Full Text] [Related]  

  • 24. Computational study on the properties and structure of methyl lactate.
    Aparicio S
    J Phys Chem A; 2007 May; 111(21):4671-83. PubMed ID: 17489567
    [TBL] [Abstract][Full Text] [Related]  

  • 25. Molecular structure and conformational composition of 1,3-dihydroxyacetone studied by combined analysis of gas-phase electron diffraction data, rotational constants, and results of theoretical calculations. Ideal gas thermodynamic properties of 1,3-dihydroxyacetone.
    Dorofeeva OV; Vogt N; Vogt J; Popik MV; Rykov AN; Vilkov LV
    J Phys Chem A; 2007 Jul; 111(28):6434-42. PubMed ID: 17595068
    [TBL] [Abstract][Full Text] [Related]  

  • 26. Oxygen atom transfer energetics: assessment of the effect of method and solvent.
    Dinescu A; Whiteley C; Combs RR; Cundari TR
    J Phys Chem A; 2006 Mar; 110(11):4053-6. PubMed ID: 16539428
    [TBL] [Abstract][Full Text] [Related]  

  • 27. How to model solvent effects on molecular properties using quantum chemistry? Insights from polarizable discrete or continuum solvation models.
    Kongsted J; Mennucci B
    J Phys Chem A; 2007 Oct; 111(39):9890-900. PubMed ID: 17845016
    [TBL] [Abstract][Full Text] [Related]  

  • 28. Photodissociation reaction of 1,2-diiodoethane in solution: a theoretical and X-ray diffraction study.
    Kong Q; Kim J; Lorenc M; Kim TK; Ihee H; Wulff M
    J Phys Chem A; 2005 Nov; 109(45):10451-8. PubMed ID: 16833343
    [TBL] [Abstract][Full Text] [Related]  

  • 29. Insights into the ethyl lactate + water mixed solvent.
    Aparicio S; Alcalde R
    J Phys Chem B; 2009 Oct; 113(43):14257-69. PubMed ID: 19803527
    [TBL] [Abstract][Full Text] [Related]  

  • 30. Hydration of cyclohexylamines: CPCM calculation of hydration Gibbs energy of the conformers.
    Jesus AJ; Tomé LI; Eusébio ME; Rosado MT; Redinha JS
    J Phys Chem A; 2007 May; 111(17):3432-7. PubMed ID: 17417830
    [TBL] [Abstract][Full Text] [Related]  

  • 31. Solvent effects on the vibronic one-photon absorption profiles of dioxaborine heterocycles.
    Wang YH; Halik M; Wang CK; Marder SR; Luo Y
    J Chem Phys; 2005 Nov; 123(19):194311. PubMed ID: 16321092
    [TBL] [Abstract][Full Text] [Related]  

  • 32. Water versus acetonitrile coordination to uranyl. Density functional study of cooperative polarization effects in solution.
    Bühl M; Sieffert N; Chaumont A; Wipff G
    Inorg Chem; 2011 Jan; 50(1):299-308. PubMed ID: 21126026
    [TBL] [Abstract][Full Text] [Related]  

  • 33. Conformation, dynamics, solvation and relative stabilities of selected beta-hexopyranoses in water: a molecular dynamics study with the GROMOS 45A4 force field.
    Kräutler V; Müller M; Hünenberger PH
    Carbohydr Res; 2007 Oct; 342(14):2097-124. PubMed ID: 17573054
    [TBL] [Abstract][Full Text] [Related]  

  • 34. Lactic acid in solution: investigations of lactic acid self-aggregation and hydrogen bonding interactions with water and methanol using vibrational absorption and vibrational circular dichroism spectroscopies.
    Losada M; Tran H; Xu Y
    J Chem Phys; 2008 Jan; 128(1):014508. PubMed ID: 18190205
    [TBL] [Abstract][Full Text] [Related]  

  • 35. First principles investigation of noncovalent complexation: a [2.2.2]-cryptand ion-binding selectivity study.
    Su JW; Burnette RR
    Chemphyschem; 2008 Oct; 9(14):1989-96. PubMed ID: 18792032
    [TBL] [Abstract][Full Text] [Related]  

  • 36. Parallelization of the integral equation formulation of the polarizable continuum model for higher-order response functions.
    Ferrighi L; Frediani L; Fossgaard E; Ruud K
    J Chem Phys; 2006 Oct; 125(15):154112. PubMed ID: 17059244
    [TBL] [Abstract][Full Text] [Related]  

  • 37. Hydration of simple amides. FTIR spectra of HDO and theoretical studies.
    Panuszko A; Gojło E; Zielkiewicz J; Smiechowski M; Krakowiak J; Stangret J
    J Phys Chem B; 2008 Feb; 112(8):2483-93. PubMed ID: 18247601
    [TBL] [Abstract][Full Text] [Related]  

  • 38. Tautomeric equilibria of pyridoxal-5'-phosphate (vitamin B6) and 3-hydroxypyridine derivatives: a theoretical study of solvation effects.
    Kiruba GS; Wong MW
    J Org Chem; 2003 Apr; 68(7):2874-81. PubMed ID: 12662064
    [TBL] [Abstract][Full Text] [Related]  

  • 39. Microscopic and macroscopic polarization within a combined quantum mechanics and molecular mechanics model.
    Jensen L; Swart M; van Duijnen PT
    J Chem Phys; 2005 Jan; 122(3):34103. PubMed ID: 15740188
    [TBL] [Abstract][Full Text] [Related]  

  • 40. Hydration-dependent structural deformation of guanine in the electronic singlet excited state.
    Shukla MK; Leszczynski J
    J Phys Chem B; 2008 Apr; 112(16):5139-52. PubMed ID: 18380499
    [TBL] [Abstract][Full Text] [Related]  

    [Previous]   [Next]    [New Search]
    of 9.