BIOMARKERS

Molecular Biopsy of Human Tumors

- a resource for Precision Medicine *

231 related articles for article (PubMed ID: 22489826)

  • 21. Ab initio molecular dynamics simulation of the energy-relaxation process of the protonated water dimer.
    Yamauchi Y; Ozawa S; Nakai H
    J Phys Chem A; 2007 Mar; 111(11):2062-6. PubMed ID: 17388294
    [TBL] [Abstract][Full Text] [Related]  

  • 22. Vibrational spectroscopy of protonated imidazole and its complexes with water molecules: ab initio anharmonic calculations and experiments.
    Adesokan AA; Chaban GM; Dopfer O; Gerber RB
    J Phys Chem A; 2007 Aug; 111(31):7374-81. PubMed ID: 17500546
    [TBL] [Abstract][Full Text] [Related]  

  • 23. Adding water to sugar: a spectroscopic and computational study of alpha- and beta-phenylxyloside in the gas phase.
    Hünig I; Painter AJ; Jockusch RA; Carçabal P; Marzluff EM; Snoek LC; Gamblin DP; Davis BG; Simons JP
    Phys Chem Chem Phys; 2005 Jun; 7(12):2474-80. PubMed ID: 15962032
    [TBL] [Abstract][Full Text] [Related]  

  • 24. Structure of protonated carbon dioxide clusters: infrared photodissociation spectroscopy and ab initio calculations.
    Douberly GE; Ricks AM; Ticknor BW; Duncan MA
    J Phys Chem A; 2008 Feb; 112(5):950-9. PubMed ID: 18193850
    [TBL] [Abstract][Full Text] [Related]  

  • 25. Ab initio molecular dynamics simulations investigating proton transfer in perfluorosulfonic acid functionalized carbon nanotubes.
    Habenicht BF; Paddison SJ; Tuckerman ME
    Phys Chem Chem Phys; 2010 Aug; 12(31):8728-32. PubMed ID: 20556301
    [TBL] [Abstract][Full Text] [Related]  

  • 26. Ab initio molecular dynamics simulation of proton hopping in a model polymer membrane.
    Devanathan R; Idupulapati N; Baer MD; Mundy CJ; Dupuis M
    J Phys Chem B; 2013 Dec; 117(51):16522-9. PubMed ID: 24320080
    [TBL] [Abstract][Full Text] [Related]  

  • 27. Proton transport in triflic acid pentahydrate studied via ab initio path integral molecular dynamics.
    Hayes RL; Paddison SJ; Tuckerman ME
    J Phys Chem A; 2011 Jun; 115(23):6112-24. PubMed ID: 21434672
    [TBL] [Abstract][Full Text] [Related]  

  • 28. Car-Parrinello molecular dynamics study of the intramolecular vibrational mode-sensitive double proton-transfer mechanisms in porphycene.
    Walewski Ł; Waluk J; Lesyng B
    J Phys Chem A; 2010 Feb; 114(6):2313-8. PubMed ID: 20099852
    [TBL] [Abstract][Full Text] [Related]  

  • 29. Mechanisms of proton transfer in Nafion: elementary reactions at the sulfonic acid groups.
    Sagarik K; Phonyiem M; Lao-ngam C; Chaiwongwattana S
    Phys Chem Chem Phys; 2008 Apr; 10(15):2098-112. PubMed ID: 18688364
    [TBL] [Abstract][Full Text] [Related]  

  • 30. Theoretical evidence of barrier-free proton transfer in 7-azaindole-water cluster anions.
    Chen HY; Young PY; Hsu SC
    J Chem Phys; 2009 Apr; 130(16):165101. PubMed ID: 19405633
    [TBL] [Abstract][Full Text] [Related]  

  • 31. Conformational choice and selectivity in singly and multiply hydrated monosaccharides in the gas phase.
    Cocinero EJ; Stanca-Kaposta EC; Scanlan EM; Gamblin DP; Davis BG; Simons JP
    Chemistry; 2008; 14(29):8947-8955. PubMed ID: 18720336
    [TBL] [Abstract][Full Text] [Related]  

  • 32. Dynamics and mechanism of structural diffusion in linear hydrogen bond.
    Chaiwongwattana S; Phonyiem M; Vchirawongkwin V; Prueksaaroon S; Sagarik K
    J Comput Chem; 2012 Jan; 33(2):175-88. PubMed ID: 22009491
    [TBL] [Abstract][Full Text] [Related]  

  • 33. Hydrogen forms in water by proton transfer to a distorted electron.
    Marsalek O; Frigato T; VandeVondele J; Bradforth SE; Schmidt B; Schütte C; Jungwirth P
    J Phys Chem B; 2010 Jan; 114(2):915-20. PubMed ID: 19961167
    [TBL] [Abstract][Full Text] [Related]  

  • 34. Proton transfer reactions and dynamics of sulfonic acid group in Nafion®.
    Phonyiem M; Chaiwongwattana S; Lao-ngam C; Sagarik K
    Phys Chem Chem Phys; 2011 Jun; 13(23):10923-39. PubMed ID: 21584294
    [TBL] [Abstract][Full Text] [Related]  

  • 35. Quantum proton transfer in hydrated sulfuric acid clusters: a perspective from semiempirical path integral simulations.
    Sugawara S; Yoshikawa T; Takayanagi T; Shiga M; Tachikawa M
    J Phys Chem A; 2011 Oct; 115(42):11486-94. PubMed ID: 21910433
    [TBL] [Abstract][Full Text] [Related]  

  • 36. Crucial role of solvent-impacted molecular anionic resonances in controlling protonation modes in the acetonitrile-water anionic cluster revealed by ab initio molecular dynamics simulations.
    Wang S; Liu J; Zhang C; Guo L; Bu Y
    J Phys Chem A; 2014 Oct; 118(39):9212-9. PubMed ID: 24831567
    [TBL] [Abstract][Full Text] [Related]  

  • 37. Infrared spectroscopy of hydrated amino acids in the gas phase: protonated and lithiated valine.
    Kamariotis A; Boyarkin OV; Mercier SR; Beck RD; Bush MF; Williams ER; Rizzo TR
    J Am Chem Soc; 2006 Jan; 128(3):905-16. PubMed ID: 16417381
    [TBL] [Abstract][Full Text] [Related]  

  • 38. Proton hydration in aqueous solution: Fourier transform infrared studies of HDO spectra.
    Smiechowski M; Stangret J
    J Chem Phys; 2006 Nov; 125(20):204508. PubMed ID: 17144716
    [TBL] [Abstract][Full Text] [Related]  

  • 39. Computational studies of aqueous-phase photochemistry and the hydrated electron in finite-size clusters.
    Sobolewski AL; Domcke W
    Phys Chem Chem Phys; 2007 Aug; 9(29):3818-29. PubMed ID: 17637974
    [TBL] [Abstract][Full Text] [Related]  

  • 40. A generalized reactive force field for nonlinear hydrogen bonds: hydrogen dynamics and transfer in malonaldehyde.
    Yang Y; Meuwly M
    J Chem Phys; 2010 Aug; 133(6):064503. PubMed ID: 20707571
    [TBL] [Abstract][Full Text] [Related]  

    [Previous]   [Next]    [New Search]
    of 12.