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 *

218 related articles for article (PubMed ID: 21853969)

  • 1. Methyl formate and its mono and difluoro derivatives: conformational manifolds, basicity, and interaction with HF theoretical investigation.
    Zeegers-Huyskens T; Kryachko ES
    J Phys Chem A; 2011 Nov; 115(45):12586-601. PubMed ID: 21853969
    [TBL] [Abstract][Full Text] [Related]  

  • 2. Theoretical investigation of the conformation, acidity, basicity and hydrogen bonding ability of halogenated ethers.
    Zierkiewicz W; Michalska D; Zeegers-Huyskens T
    Phys Chem Chem Phys; 2010 Nov; 12(41):13681-91. PubMed ID: 20856955
    [TBL] [Abstract][Full Text] [Related]  

  • 3. Strong hyperconjugative interactions in isolated and water complexes of desflurane: a theoretical investigation.
    Sutradhar D; Zeegers-Huyskens T; Chandra AK
    J Phys Chem A; 2013 Sep; 117(36):8545-54. PubMed ID: 23547928
    [TBL] [Abstract][Full Text] [Related]  

  • 4. A theoretical investigation of the interaction between substituted carbonyl derivatives and water: open or cyclic complexes?
    Chandra AK; Zeegers-Huyskens T
    J Comput Chem; 2012 Apr; 33(11):1131-41. PubMed ID: 22344933
    [TBL] [Abstract][Full Text] [Related]  

  • 5. Theoretical study of (CH...C)- hydrogen bonds in CH(4-n)X(n) (X = F, Cl; n = 0, 1, 2) systems complexed with their homoconjugate and heteroconjugate carbanions.
    Chandra AK; Zeegers-Huyskens T
    J Phys Chem A; 2005 Dec; 109(51):12006-13. PubMed ID: 16366655
    [TBL] [Abstract][Full Text] [Related]  

  • 6. Theoretical investigation of the interaction between fluorinated dimethyl ethers (nF = 1-5) and water: role of the acidity and basicity on the competition between OH...O and CH...O hydrogen bonds.
    Parveen S; Chandra AK; Zeegers-Huyskens T
    J Phys Chem A; 2009 May; 113(21):6182-91. PubMed ID: 19422184
    [TBL] [Abstract][Full Text] [Related]  

  • 7. Electronic properties of multifurcated bent hydrogen bonds CH3...Y and CH2...Y.
    Li AY; Yan XH
    Phys Chem Chem Phys; 2007 Dec; 9(47):6263-71. PubMed ID: 18046475
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Blue shifts of the C-H stretching vibrations in hydrogen-bonded and protonated trimethylamine. Effect of hyperconjugation on bond properties.
    Chandra AK; Parveen S; Das S; Zeegers-Huyskens T
    J Comput Chem; 2008 Jul; 29(9):1490-6. PubMed ID: 18270959
    [TBL] [Abstract][Full Text] [Related]  

  • 9. An ab initio study of the C2H2-HF, C2H(CH3)-HF and C2(CH3)2-HF hydrogen-bonded complexes.
    Ramos MN; Lopes KC; Silva WL; Tavares AM; Castriani FA; do Monte SA; Ventura E; Araújo RC
    Spectrochim Acta A Mol Biomol Spectrosc; 2006 Feb; 63(2):383-90. PubMed ID: 16427352
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Theoretical and experimental studies of enflurane. Infrared spectra in solution, in low-temperature argon matrix and blue shifts resulting from dimerization.
    Michalska D; Bieńko DC; Czarnik-Matusewicz B; Wierzejewska M; Sandorfy C; Zeegers-Huyskens T
    J Phys Chem B; 2007 Oct; 111(42):12228-38. PubMed ID: 17914793
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Conformational stability, the spectroscopic (FT-IR and UV), first order hyperpolarizability, NBO analysis, HOMO and LUMO analysis of 6,8-diphenylimidazo[1,2-α]pyrazine molecule by ab initio HF and density functional methods.
    Sıdır İ; Sıdır YG; Kayagil İ
    Spectrochim Acta A Mol Biomol Spectrosc; 2011 Oct; 81(1):339-52. PubMed ID: 21782498
    [TBL] [Abstract][Full Text] [Related]  

  • 12. A theoretical study of hydrogen complexes of the XH-pi type between propyne and HF, HCL or HCN.
    Tavares AM; da Silva WL; Lopes KC; Ventura E; Araújo RC; do Monte SA; da Silva JB; Ramos MN
    Spectrochim Acta A Mol Biomol Spectrosc; 2006 May; 64(2):412-7. PubMed ID: 16330245
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Anomeric effects in the symmetrical and asymmetrical structures of triethylamine. Blue-shifts of the C-h stretching vibrations in complexed and protonated triethylamine.
    Chandra AK; Parveen S; Zeegers-Huyskens T
    J Phys Chem A; 2007 Sep; 111(36):8884-91. PubMed ID: 17711270
    [TBL] [Abstract][Full Text] [Related]  

  • 14. Quantification of hyperconjugative effect on the proton donor X-H bond length changes in the red- and blueshifted hydrogen-bonded complexes.
    Zhou PP; Qiu WY; Jin NZ
    J Chem Phys; 2012 Aug; 137(8):084311. PubMed ID: 22938237
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Intramolecular hydrogen bonding in disubstituted ethanes. A comparison of NH...O- and OH...O- Hydrogen bonding through conformational analysis of 4-amino-4-oxobutanoate (succinamate) and monohydrogen 1,4-butanoate (monohydrogen succinate) anions.
    Rudner MS; Jeremic S; Petterson KA; Kent DR; Brown KA; Drake MD; Goddard WA; Roberts JD
    J Phys Chem A; 2005 Oct; 109(40):9076-82. PubMed ID: 16332014
    [TBL] [Abstract][Full Text] [Related]  

  • 16. On the origin of red and blue shifts of X-H and C-H stretching vibrations in formic acid (formate ion) and proton donor complexes.
    Tâme Parreira RL; Galembeck SE; Hobza P
    Chemphyschem; 2007 Jan; 8(1):87-92. PubMed ID: 17121408
    [TBL] [Abstract][Full Text] [Related]  

  • 17. DFT study of the interaction between 3-nitro-1,2,4-triazole-5-one and hydrogen fluoride.
    Fang G; Xu L; Hu X; Li X
    J Hazard Mater; 2008 Dec; 160(1):51-5. PubMed ID: 18400387
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Structural features and hydrogen-bond properties of galanthamine and codeine: an experimental and theoretical study.
    Atkinson AP; Baguet E; Galland N; Le Questel JY; Planchat A; Graton J
    Chemistry; 2011 Oct; 17(41):11637-49. PubMed ID: 21887829
    [TBL] [Abstract][Full Text] [Related]  

  • 19. Theoretical investigation of hydrogen bonds between CO and HNF2, H2NF, and HNO.
    Li AY
    J Phys Chem A; 2006 Sep; 110(37):10805-16. PubMed ID: 16970375
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Combined experimental and theoretical study on hydrogen-bonded complexes between cyclic ketones, lactones, and lactams with 3,4-dinitrophenol.
    Esseffar M; El Firdoussi A; Bouab W; Abboud JL; Mó O; Yáñez M
    J Phys Chem A; 2009 Dec; 113(52):14711-7. PubMed ID: 19824667
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 11.