BIOMARKERS

Molecular Biopsy of Human Tumors

- a resource for Precision Medicine *

113 related articles for article (PubMed ID: 24435016)

  • 1. On the coupling of solvent characteristics to the electronic structure of solute molecules.
    Bogatko S; Cauët E; Geerlings P; De Proft F
    Phys Chem Chem Phys; 2014 Feb; 16(8):3807-14. PubMed ID: 24435016
    [TBL] [Abstract][Full Text] [Related]  

  • 2. 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]  

  • 3. Nature of sodium atoms/(Na(+), e(-)) contact pairs in liquid tetrahydrofuran.
    Glover WJ; Larsen RE; Schwartz BJ
    J Phys Chem B; 2010 Sep; 114(35):11535-43. PubMed ID: 20809654
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Watching Na atoms solvate into (Na+,e-) contact pairs: untangling the ultrafast charge-transfer-to-solvent dynamics of Na- in tetrahydrofuran (THF).
    Cavanagh MC; Larsen RE; Schwartz BJ
    J Phys Chem A; 2007 Jun; 111(24):5144-57. PubMed ID: 17523607
    [TBL] [Abstract][Full Text] [Related]  

  • 5. Solvent-dependent structure of molecular iodine probed by picosecond X-ray solution scattering.
    Kim KH; Ki H; Lee JH; Park S; Kong Q; Kim J; Kim J; Wulff M; Ihee H
    Phys Chem Chem Phys; 2015 Apr; 17(14):8633-7. PubMed ID: 25760386
    [TBL] [Abstract][Full Text] [Related]  

  • 6. The roles of electronic exchange and correlation in charge-transfer- to-solvent dynamics: Many-electron nonadiabatic mixed quantum/classical simulations of photoexcited sodium anions in the condensed phase.
    Glover WJ; Larsen RE; Schwartz BJ
    J Chem Phys; 2008 Oct; 129(16):164505. PubMed ID: 19045282
    [TBL] [Abstract][Full Text] [Related]  

  • 7. Solvatochromic shifts of polar and non-polar molecules in ambient and supercritical water: a sequential quantum mechanics/molecular mechanics study including solute-solvent electron exchange-correlation.
    Ma H; Ma Y
    J Chem Phys; 2012 Dec; 137(21):214504. PubMed ID: 23231248
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Microhydration shell structure in Cl2*-.nH2O clusters: A theoretical study.
    Pathak AK; Mukherjee T; Maity DK
    J Chem Phys; 2006 Aug; 125(7):074309. PubMed ID: 16942341
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Solvent density inhomogeneities and solvation free energies in supercritical diatomic fluids: a density functional approach.
    Husowitz B; Talanquer V
    J Chem Phys; 2007 Feb; 126(5):054508. PubMed ID: 17302486
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Convergence behaviour of solvation shells in simulated liquids.
    Kalayan J; Henchman RH
    Phys Chem Chem Phys; 2021 Mar; 23(8):4892-4900. PubMed ID: 33616583
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Halogen-hydride interaction between Z-X (Z = CN, NC; X = F, Cl, Br) and H-Mg-Y (Y = H, F, Cl, Br, CH3).
    Mohajeri A; Alipour M; Mousaee M
    J Phys Chem A; 2011 May; 115(17):4457-66. PubMed ID: 21456584
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Effects of solute structure on local solvation and solvent interactions: results from UV/vis spectroscopy and molecular dynamics simulations.
    Gohres JL; Shukla CL; Popov AV; Hernandez R; Liotta CL; Eckert CA
    J Phys Chem B; 2008 Nov; 112(47):14993-8. PubMed ID: 18975884
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Filming the birth of molecules and accompanying solvent rearrangement.
    Lee JH; Wulff M; Bratos S; Petersen J; Guerin L; Leicknam JC; Cammarata M; Kong Q; Kim J; Møller KB; Ihee H
    J Am Chem Soc; 2013 Feb; 135(8):3255-61. PubMed ID: 23374032
    [TBL] [Abstract][Full Text] [Related]  

  • 14. Solvatochromic and thermochromic shifts of electronic spectra of polar solute molecules in a mixture of polar and nonpolar solvent; the role of solvent-solvent interactions.
    Gorbatsevich SK; Smirnova OY
    J Chem Phys; 2004 Jan; 120(3):1369-74. PubMed ID: 15268262
    [TBL] [Abstract][Full Text] [Related]  

  • 15. An SCF Solvation Model for the Hydrophobic Effect and Absolute Free Energies of Aqueous Solvation.
    Cramer CJ; Truhlar DG
    Science; 1992 Apr; 256(5054):213-7. PubMed ID: 17744720
    [TBL] [Abstract][Full Text] [Related]  

  • 16. The effects of solute-solvent electrostatic interactions on solvation dynamics in supercritical CO2.
    Ladanyi BM; Nugent S
    J Chem Phys; 2006 Jan; 124(4):044505. PubMed ID: 16460183
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Solute-solvent intermolecular vibronic coupling as manifested by the molecular near-field effect in resonance hyper-Raman scattering.
    Shimada R; Hamaguchi HO
    J Chem Phys; 2011 Jan; 134(3):034516. PubMed ID: 21261377
    [TBL] [Abstract][Full Text] [Related]  

  • 18. A 3D-RISM-SCF method with dual solvent boxes for a highly polarized system: application to 1,6-anhydrosugar formation reaction of phenyl α- and β-D-glucosides under basic conditions.
    Aono S; Hosoya T; Sakaki S
    Phys Chem Chem Phys; 2013 May; 15(17):6368-81. PubMed ID: 23525092
    [TBL] [Abstract][Full Text] [Related]  

  • 19. The ultrafast charge-transfer-to-solvent dynamics of iodide in tetrahydrofuran. 1. Exploring the roles of solvent and solute electronic structure in condensed-phase charge-transfer reactions.
    Bragg AE; Schwartz BJ
    J Phys Chem B; 2008 Jan; 112(2):483-94. PubMed ID: 18085770
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Solvent effects on global reactivity properties for neutral and charged systems using the sequential Monte Carlo quantum mechanics model.
    Jaramillo P; Pérez P; Fuentealba P; Canuto S; Coutinho K
    J Phys Chem B; 2009 Apr; 113(13):4314-22. PubMed ID: 19320524
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 6.