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 *

228 related articles for article (PubMed ID: 17165889)

  • 1. The case of the weak N-X bond: Ab initio, semi-experimental, and experimental equilibrium structures of XNO (X = H, F, Cl, OH) and FNO2.
    Demaison J; Császár AG; Dehayem-Kamadjeu A
    J Phys Chem A; 2006 Dec; 110(50):13609-17. PubMed ID: 17165889
    [TBL] [Abstract][Full Text] [Related]  

  • 2. Equilibrium structure and torsional barrier of BH3NH3.
    Demaison J; Liévin J; Császár AG; Gutle C
    J Phys Chem A; 2008 May; 112(19):4477-82. PubMed ID: 18422295
    [TBL] [Abstract][Full Text] [Related]  

  • 3. Comparison of the experimental, semi-experimental and ab initio equilibrium structures of acetylene: influence of relativisitic effects and of the diagonal Born-Oppenheimer corrections.
    Liévin J; Demaison J; Herman M; Fayt A; Puzzarini C
    J Chem Phys; 2011 Feb; 134(6):064119. PubMed ID: 21322673
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Equilibrium structures of heterocyclic molecules with large principal axis rotations upon isotopic substitution.
    Demaison J; Császár AG; Margulès LD; Rudolph HD
    J Phys Chem A; 2011 Dec; 115(48):14078-91. PubMed ID: 22032750
    [TBL] [Abstract][Full Text] [Related]  

  • 5. Study of the thymine molecule: equilibrium structure from joint analysis of gas-phase electron diffraction and microwave data and assignment of vibrational spectra using results of ab initio calculations.
    Vogt N; Khaikin LS; Grikina OE; Rykov AN; Vogt J
    J Phys Chem A; 2008 Aug; 112(33):7662-70. PubMed ID: 18665577
    [TBL] [Abstract][Full Text] [Related]  

  • 6. Coupled-cluster calculations of C(2)H(2)Si and CNHSi structural isomers.
    Thorwirth S; Harding ME
    J Chem Phys; 2009 Jun; 130(21):214303. PubMed ID: 19508065
    [TBL] [Abstract][Full Text] [Related]  

  • 7. Experimental and ab Initio Equilibrium Structure and Harmonic Force Field of 1,2,5-Oxadiazole.
    Vázquez J; Demaison J; López-González JJ; Boggs JE; Rudolph HD
    J Mol Spectrosc; 2001 Jun; 207(2):224-237. PubMed ID: 11397111
    [TBL] [Abstract][Full Text] [Related]  

  • 8. An investigation of the molecular geometry and electronic structure of nitryl chloride by a combination of rotational spectroscopy and ab initio calculations.
    Francis SG; Harvey JN; Walker NR; Legon AC
    J Chem Phys; 2008 May; 128(20):204305. PubMed ID: 18513017
    [TBL] [Abstract][Full Text] [Related]  

  • 9. On the stability of X2NO radicals (X = F, Cl, Br, I).
    Puzzarini C; Barone V
    Phys Chem Chem Phys; 2009 Dec; 11(48):11463-70. PubMed ID: 20024417
    [TBL] [Abstract][Full Text] [Related]  

  • 10. On equilibrium structures of the water molecule.
    Császár AG; Czakó G; Furtenbacher T; Tennyson J; Szalay V; Shirin SV; Zobov NF; Polyansky OL
    J Chem Phys; 2005 Jun; 122(21):214305. PubMed ID: 15974736
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Anharmonic force field of cis- and trans-formic acid from high-level ab initio calculations, and analysis of resonance polyads.
    Demaison J; Herman M; Liévin J
    J Chem Phys; 2007 Apr; 126(16):164305. PubMed ID: 17477600
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Accurate determination of the structure of cyclooctatetraene by femtosecond rotational coherence spectroscopy and ab initio calculations.
    Kummli DS; Lobsiger S; Frey HM; Leutwyler S; Stanton JF
    J Phys Chem A; 2008 Sep; 112(38):9134-43. PubMed ID: 18754607
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Ab initio study of the structure, bonding, vibrational spectra, and energetics of XBS+ (where X=H, F, and Cl).
    Francisco JS
    J Chem Phys; 2006 Mar; 124(11):114303. PubMed ID: 16555884
    [TBL] [Abstract][Full Text] [Related]  

  • 14. The structure of the phenol-nitrogen cluster: a joint experimental and ab initio study.
    Schmitt M; Ratzer C; Meerts WL
    J Chem Phys; 2004 Feb; 120(6):2752-8. PubMed ID: 15268420
    [TBL] [Abstract][Full Text] [Related]  

  • 15. The ground state energy levels and molecular structure of jet-cooled HGeCl and DGeCl from single vibronic level emission spectroscopy.
    Tackett BS; Clouthier DJ; Pacheco KL; Schick GA
    J Chem Phys; 2006 Mar; 124(12):124320. PubMed ID: 16599687
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Microwave spectra, ab initio calculations, and r0 structural parameters for (methylamino)thiophosphoryl difluoride.
    Durig JR; Zheng C; Xiao J; Zhao W; Sanders RS; van der Veken BJ
    J Phys Chem A; 2006 Jul; 110(26):8037-43. PubMed ID: 16805489
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Ab initio prediction of the potential energy surface and vibrational-rotational energy levels of dialuminum monoxide, Al2O.
    Koput J; Gertych A
    J Chem Phys; 2004 Jul; 121(1):130-5. PubMed ID: 15260529
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Rotational spectra of rare isotopic species of bromofluoromethane: determination of the equilibrium structure from ab initio calculations and microwave spectroscopy.
    Puzzarini C; Cazzoli G; Baldacci A; Baldan A; Michauk C; Gauss J
    J Chem Phys; 2007 Oct; 127(16):164302. PubMed ID: 17979333
    [TBL] [Abstract][Full Text] [Related]  

  • 19. Equilibrium Structure and Spectroscopic Constants of Difluorovinylidene: An ab Initio Study.
    Breidung J; Thiel W
    J Mol Spectrosc; 2001 Jan; 205(1):28-37. PubMed ID: 11148104
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Structure and energetics of gaseous HZnCl.
    Kerkines IS; Mavridis A; Karipidis PA
    J Phys Chem A; 2006 Sep; 110(37):10899-903. PubMed ID: 16970387
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 12.