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 *

170 related articles for article (PubMed ID: 15453803)

  • 1. Accurate and efficient method for predicting thermochemistry of polycyclic aromatic hydrocarbons - bond-centered group additivity.
    Yu J; Sumathi R; Green WH
    J Am Chem Soc; 2004 Oct; 126(39):12685-700. PubMed ID: 15453803
    [TBL] [Abstract][Full Text] [Related]  

  • 2. Accurate and efficient method for predicting thermochemistry of furans and ortho-arynes: expansion of the bond-centered group additivity method.
    Yu J; Sumathi R; Green WH
    J Phys Chem A; 2006 Jun; 110(21):6971-7. PubMed ID: 16722711
    [TBL] [Abstract][Full Text] [Related]  

  • 3. Reliable predictions of the thermochemistry of boron-nitrogen hydrogen storage compounds: BxNxHy, x = 2, 3.
    Matus MH; Anderson KD; Camaioni DM; Autrey ST; Dixon DA
    J Phys Chem A; 2007 May; 111(20):4411-21. PubMed ID: 17444621
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Thermochemical properties, rotation barriers, and group additivity for unsaturated oxygenated hydrocarbons and radicals resulting from reaction of vinyl and phenyl radical systems with O2.
    Sebbarand N; Bockhorn H; Bozzelli JW
    J Phys Chem A; 2005 Mar; 109(10):2233-53. PubMed ID: 16838995
    [TBL] [Abstract][Full Text] [Related]  

  • 5. Structure and thermochemical properties of 2-methoxyfuran, 3-methoxyfuran, and their carbon-centered radicals using computational chemistry.
    Hudzik JM; Bozzelli JW
    J Phys Chem A; 2010 Aug; 114(30):7984-95. PubMed ID: 20666545
    [TBL] [Abstract][Full Text] [Related]  

  • 6. Thermochemistry, bond energies, and internal rotor potentials of dimethyl tetraoxide.
    da Silva G; Bozzelli JW
    J Phys Chem A; 2007 Nov; 111(47):12026-36. PubMed ID: 17983209
    [TBL] [Abstract][Full Text] [Related]  

  • 7. Theoretical prediction of the heats of formation of C2H5O* radicals derived from ethanol and of the kinetics of beta-C-C scission in the ethoxy radical.
    Matus MH; Nguyen MT; Dixon DA
    J Phys Chem A; 2007 Jan; 111(1):113-26. PubMed ID: 17201394
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Thermodynamic properties (enthalpy, bond energy, entropy, and heat capacity) and internal rotor potentials of vinyl alcohol, methyl vinyl ether, and their corresponding radicals.
    da Silva G; Kim CH; Bozzelli JW
    J Phys Chem A; 2006 Jun; 110(25):7925-34. PubMed ID: 16789782
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Modeling the gas-phase thermochemistry of organosulfur compounds.
    Vandeputte AG; Sabbe MK; Reyniers MF; Marin GB
    Chemistry; 2011 Jun; 17(27):7656-73. PubMed ID: 21608056
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Enthalpies of formation, bond dissociation energies, and molecular structures of the n-aldehydes (acetaldehyde, propanal, butanal, pentanal, hexanal, and heptanal) and their radicals.
    da Silva G; Bozzelli JW
    J Phys Chem A; 2006 Dec; 110(48):13058-67. PubMed ID: 17134166
    [TBL] [Abstract][Full Text] [Related]  

  • 11. First principles based group additive values for the gas phase standard entropy and heat capacity of hydrocarbons and hydrocarbon radicals.
    Sabbe MK; De Vleeschouwer F; Reyniers MF; Waroquier M; Marin GB
    J Phys Chem A; 2008 Nov; 112(47):12235-51. PubMed ID: 18980365
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Thermochemistry of Pt-fullerene complexes: semiempirical study.
    Voityuk AA
    J Phys Chem A; 2009 Oct; 113(43):11801-8. PubMed ID: 19848428
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Accurate heats of formation of the "Arduengo-type" carbene and various adducts including H2 from ab initio molecular orbital theory.
    Dixon DA; Arduengo AJ
    J Phys Chem A; 2006 Feb; 110(5):1968-74. PubMed ID: 16451031
    [TBL] [Abstract][Full Text] [Related]  

  • 14. Ring conserved isodesmic reactions: A new method for estimating the heats of formation of aromatics and PAHs.
    Sivaramakrishnan R; Tranter RS; Brezinsky K
    J Phys Chem A; 2005 Mar; 109(8):1621-8. PubMed ID: 16833486
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Thermochemical data and additivity group values for ten species of o-xylene low-temperature oxidation mechanism.
    Canneaux S; Vandeputte R; Hammaecher C; Louis F; Ribaucour M
    J Phys Chem A; 2012 Jan; 116(1):592-610. PubMed ID: 22204492
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Nonplanar distortions and strain energies of polycyclic aromatic hydrocarbons.
    Sun CH; Lu GQ; Cheng HM
    J Phys Chem B; 2006 Mar; 110(10):4563-8. PubMed ID: 16526685
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Thermochemical properties, DeltafH degrees (298), S degrees (298), and Cp degrees (T), for n-butyl and n-pentyl hydroperoxides and the alkyl and peroxy radicals, transition states, and kinetics for intramolecular hydrogen shift reactions of the peroxy radicals.
    Zhu L; Bozzelli JW; Kardos LM
    J Phys Chem A; 2007 Jul; 111(28):6361-77. PubMed ID: 17585739
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Theoretical study of the enthalpies of formation for C40H56 carotenes.
    Tu CY; Guo WH; Hu CH
    J Phys Chem A; 2008 Jan; 112(1):117-24. PubMed ID: 18069804
    [TBL] [Abstract][Full Text] [Related]  

  • 19. Thermochemistry of new molecular species: SBr and HSBr.
    Ornellas FR
    J Chem Phys; 2007 May; 126(20):204314. PubMed ID: 17552769
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Increasing stability of the fullerenes with the number of carbon atoms: the experimental evidence.
    Rojas A; Martínez M; Amador P; Torres LA
    J Phys Chem B; 2007 Aug; 111(30):9031-5. PubMed ID: 17608526
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 9.