BIOMARKERS

Molecular Biopsy of Human Tumors

- a resource for Precision Medicine *

185 related articles for article (PubMed ID: 29476061)

  • 21. Role of the substituent effect over the squarate oxocarbonic ring: spectroscopy, crystal structure, and density functional theory calculations of 1,2-dianilinosquairane.
    Silva CE; Dos Santos HF; Speziali NL; Diniz R; de Oliveira LF
    J Phys Chem A; 2010 Sep; 114(37):10097-109. PubMed ID: 20735014
    [TBL] [Abstract][Full Text] [Related]  

  • 22. A DFT/TDDFT study on the excited-state hydrogen bonding dynamics of 6-aminocoumarin in water solution.
    Zhang M; Ren B; Wang Y; Zhao C
    Spectrochim Acta A Mol Biomol Spectrosc; 2013 Jan; 101():191-5. PubMed ID: 23103460
    [TBL] [Abstract][Full Text] [Related]  

  • 23. Microsolvation and hydrogen bond interactions in Glycine Dipeptide: molecular dynamics and density functional theory studies.
    Yogeswari B; Kanakaraju R; Boopathi S; Kolandaivel P
    J Mol Graph Model; 2012 May; 35():11-20. PubMed ID: 22481074
    [TBL] [Abstract][Full Text] [Related]  

  • 24. Ultrafast intermolecular hydrogen bond dynamics in the excited state of fluorenone.
    Samant V; Singh AK; Ramakrishna G; Ghosh HN; Ghanty TK; Palit DK
    J Phys Chem A; 2005 Oct; 109(39):8693-704. PubMed ID: 16834271
    [TBL] [Abstract][Full Text] [Related]  

  • 25. Rotational and translational dynamics and their relation to hydrogen bond lifetimes in an ionic liquid by means of NMR relaxation time experiments and molecular dynamics simulation.
    Strate A; Neumann J; Overbeck V; Bonsa AM; Michalik D; Paschek D; Ludwig R
    J Chem Phys; 2018 May; 148(19):193843. PubMed ID: 30307203
    [TBL] [Abstract][Full Text] [Related]  

  • 26. Excited state hydrogen bond and proton transfer mechanism for (2‑hydroxy‑4‑methoxyphenyl)(phenyl)‑methanone azine: A theoretical investigation.
    Yang D; Yang G; Jia M; Song X; Zhang Q; Zhang T
    Spectrochim Acta A Mol Biomol Spectrosc; 2019 Mar; 210():159-164. PubMed ID: 30453191
    [TBL] [Abstract][Full Text] [Related]  

  • 27. Accurate ab initio calculations of O-HO and O-H(-)O proton chemical shifts: towards elucidation of the nature of the hydrogen bond and prediction of hydrogen bond distances.
    Siskos MG; Tzakos AG; Gerothanassis IP
    Org Biomol Chem; 2015 Sep; 13(33):8852-68. PubMed ID: 26196256
    [TBL] [Abstract][Full Text] [Related]  

  • 28. Hydrogen-bond-dynamics-based switching of conductivity and magnetism: a phase transition caused by deuterium and electron transfer in a hydrogen-bonded purely organic conductor crystal.
    Ueda A; Yamada S; Isono T; Kamo H; Nakao A; Kumai R; Nakao H; Murakami Y; Yamamoto K; Nishio Y; Mori H
    J Am Chem Soc; 2014 Aug; 136(34):12184-92. PubMed ID: 25127315
    [TBL] [Abstract][Full Text] [Related]  

  • 29. Hydrogen bonding in helical polypeptides from molecular dynamics simulations and amide hydrogen exchange analysis: alamethicin and melittin in methanol.
    Sessions RB; Gibbs N; Dempsey CE
    Biophys J; 1998 Jan; 74(1):138-52. PubMed ID: 9449318
    [TBL] [Abstract][Full Text] [Related]  

  • 30. Effects of hydrogen bond on 2-aminopyridine and its derivatives complexes in methanol solvent.
    Zhao J; Song P; Cui Y; Liu X; Sun S; Hou S; Ma F
    Spectrochim Acta A Mol Biomol Spectrosc; 2014 Oct; 131():282-7. PubMed ID: 24835930
    [TBL] [Abstract][Full Text] [Related]  

  • 31. Solvent effect and hydrogen bond interaction on tautomerism, vibrational frequencies, and Raman spectra of guanine: a density functional theoretical study.
    Yu LJ; Pang R; Tao S; Yang HT; Wu DY; Tian ZQ
    J Phys Chem A; 2013 May; 117(20):4286-96. PubMed ID: 23631619
    [TBL] [Abstract][Full Text] [Related]  

  • 32. Understanding the effect of nanoconfinement on the structure of water hydrogen bond networks.
    Oh MI; Gupta M; Oh CI; Weaver DF
    Phys Chem Chem Phys; 2019 Dec; 21(47):26237-26250. PubMed ID: 31769468
    [TBL] [Abstract][Full Text] [Related]  

  • 33. The effect of hydrogen bonding on the excited-state proton transfer in 2-(2'-hydroxyphenyl)benzothiazole: a TDDFT molecular dynamics study.
    Kungwan N; Plasser F; Aquino AJ; Barbatti M; Wolschann P; Lischka H
    Phys Chem Chem Phys; 2012 Jul; 14(25):9016-25. PubMed ID: 22495201
    [TBL] [Abstract][Full Text] [Related]  

  • 34. Influence of substitution, hybridization, and solvent on the properties of C-HO single-electron hydrogen bond in CH3-H2O complex.
    An X; Liu H; Li Q; Gong B; Cheng J
    J Phys Chem A; 2008 Jun; 112(23):5258-63. PubMed ID: 18479113
    [TBL] [Abstract][Full Text] [Related]  

  • 35. Ultrafast dynamics of the excited states of curcumin in solution.
    Ghosh R; Mondal JA; Palit DK
    J Phys Chem B; 2010 Sep; 114(37):12129-43. PubMed ID: 20806946
    [TBL] [Abstract][Full Text] [Related]  

  • 36. The role of hydrogen bonding in the enzymatic reaction catalyzed by HIV-1 protease.
    Trylska J; Grochowski P; McCammon JA
    Protein Sci; 2004 Feb; 13(2):513-28. PubMed ID: 14739332
    [TBL] [Abstract][Full Text] [Related]  

  • 37. Combined Molecular Dynamics, Atoms in Molecules, and IR Studies of the Bulk Monofluoroethanol and Bulk Ethanol To Understand the Role of Organic Fluorine in the Hydrogen Bond Network.
    Biswas B; Mondal S; Singh PC
    J Phys Chem A; 2017 Feb; 121(6):1250-1260. PubMed ID: 28099019
    [TBL] [Abstract][Full Text] [Related]  

  • 38. Early time hydrogen-bonding dynamics of photoexcited coumarin 102 in hydrogen-donating solvents: theoretical study.
    Zhao GJ; Han KL
    J Phys Chem A; 2007 Apr; 111(13):2469-74. PubMed ID: 17388339
    [TBL] [Abstract][Full Text] [Related]  

  • 39. Charge transfer via the dative N-B bond and dihydrogen contacts. Experimental and theoretical electron density studies of small Lewis acid-base adducts.
    Mebs S; Grabowsky S; Förster D; Kickbusch R; Hartl M; Daemen LL; Morgenroth W; Luger P; Paulus B; Lentz D
    J Phys Chem A; 2010 Sep; 114(37):10185-96. PubMed ID: 20726618
    [TBL] [Abstract][Full Text] [Related]  

  • 40. Proton Transfer Dynamics in Crystalline Maleic Acid from Molecular Dynamics Calculations.
    Dopieralski PD; Latajka Z; Olovsson I
    J Chem Theory Comput; 2010 May; 6(5):1455-61. PubMed ID: 26615682
    [TBL] [Abstract][Full Text] [Related]  

    [Previous]   [Next]    [New Search]
    of 10.