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 *

119 related articles for article (PubMed ID: 17518455)

  • 1. The 1,2,3-tridehydrobenzene triradical: 2B or not 2B? The answer is 2A!
    Koziol L; Winkler M; Houk KN; Venkataramani S; Sander W; Krylov AI
    J Phys Chem A; 2007 Jun; 111(23):5071-80. PubMed ID: 17518455
    [TBL] [Abstract][Full Text] [Related]  

  • 2. Effect of a heteroatom on bonding patterns and triradical stabilization energies of 2,4,6-tridehydropyridine versus 1,3,5-tridehydrobenzene.
    Manohar PU; Koziol L; Krylov AI
    J Phys Chem A; 2009 Mar; 113(11):2591-9. PubMed ID: 19236028
    [TBL] [Abstract][Full Text] [Related]  

  • 3. Theoretical study of rhenium dinuclear complexes: Re-Re bonding nature and electronic structure.
    Saito K; Nakao Y; Sato H; Sakaki S
    J Phys Chem A; 2006 Aug; 110(31):9710-7. PubMed ID: 16884203
    [TBL] [Abstract][Full Text] [Related]  

  • 4. A fixed-node diffusion Monte Carlo study of the 1,2,3-tridehydrobenzene triradical.
    Koziol L; Morales MM
    J Chem Phys; 2014 Jun; 140(22):224316. PubMed ID: 24929397
    [TBL] [Abstract][Full Text] [Related]  

  • 5. Triradicals.
    Winkler M; Sander W
    Acc Chem Res; 2014 Jan; 47(1):31-44. PubMed ID: 23823805
    [TBL] [Abstract][Full Text] [Related]  

  • 6. Dehydrophenylnitrenes: quartet versus doublet states.
    Bettinger HF; Sander W
    J Am Chem Soc; 2003 Aug; 125(32):9726-33. PubMed ID: 12904038
    [TBL] [Abstract][Full Text] [Related]  

  • 7. Electronic structure of 1,3,5-triaminobenzene trication and related triradicals: doublet versus quartet ground state.
    Nguyen HM; Dutta A; Morokuma K; Nguyen MT
    J Chem Phys; 2005 Apr; 122(15):154308. PubMed ID: 15945636
    [TBL] [Abstract][Full Text] [Related]  

  • 8. A study of the ground and excited states of Al3 and Al3(-). I. 488 nm anion photoelectron spectrum.
    Villalta PW; Leopold DG
    J Chem Phys; 2009 Jan; 130(2):024303. PubMed ID: 19154024
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Is the 1,3,5-tridehydrobenzene triradical a cyclopropenyl radical analogue?
    Lardin HA; Nash JJ; Wenthold PG
    J Am Chem Soc; 2002 Oct; 124(42):12612-8. PubMed ID: 12381207
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Electronic structure of six-coordinate iron(III)-porphyrin NO adducts: the elusive iron(III)-NO(radical) state and its influence on the properties of these complexes.
    Praneeth VK; Paulat F; Berto TC; George SD; Näther C; Sulok CD; Lehnert N
    J Am Chem Soc; 2008 Nov; 130(46):15288-303. PubMed ID: 18942830
    [TBL] [Abstract][Full Text] [Related]  

  • 11. A study of the ground and excited states of Al3 and Al3(-). II. Computational analysis of the 488 nm anion photoelectron spectrum and a reconsideration of the Al3 bond dissociation energy.
    Miller SR; Schultz NE; Truhlar DG; Leopold DG
    J Chem Phys; 2009 Jan; 130(2):024304. PubMed ID: 19154025
    [TBL] [Abstract][Full Text] [Related]  

  • 12. A valence bond study of the low-lying states of the NF molecule.
    Su P; Wu W; Shaik S; Hiberty PC
    Chemphyschem; 2008 Jul; 9(10):1442-52. PubMed ID: 18509836
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Quantum chemical modeling of photoadsorption properties of the nitrogen-vacancy point defect in diamond.
    Zyubin AS; Mebel AM; Hayashi M; Chang HC; Lin SH
    J Comput Chem; 2009 Jan; 30(1):119-31. PubMed ID: 18548526
    [TBL] [Abstract][Full Text] [Related]  

  • 14. Triradicals.
    Krylov AI
    J Phys Chem A; 2005 Dec; 109(47):10638-45. PubMed ID: 16863112
    [TBL] [Abstract][Full Text] [Related]  

  • 15. A computational study of the ground and excited state structure and absorption spectra of free-base N-confused porphine and free-base N-confused tetraphenylporphyrin.
    Vyas S; Hadad CM; Modarelli DA
    J Phys Chem A; 2008 Jul; 112(29):6533-49. PubMed ID: 18593108
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Structure, bonding, and relative stability of the ground and low-lying electronic states of CuO2. The role of exact exchange.
    Güell M; Luis JM; Rodríguez-Santiago L; Sodupe M; Solà M
    J Phys Chem A; 2009 Feb; 113(7):1308-17. PubMed ID: 19146445
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Ground and excited electronic states of quininone-containing Re(I)-based rectangles: a comprehensive study of their preparation, electrochemistry, and photophysics.
    Bhattacharya D; Sathiyendiran M; Luo TT; Chang CH; Cheng YH; Lin CY; Lee GH; Peng SM; Lu KL
    Inorg Chem; 2009 Apr; 48(8):3731-42. PubMed ID: 19309160
    [TBL] [Abstract][Full Text] [Related]  

  • 18. The electronic spectrum of the fluoroborane free radical. I. Theoretical calculation of the vibronic energy levels of the ground and first excited electronic states.
    Sunahori FX; Clouthier DJ; Carter S; Tarroni R
    J Chem Phys; 2009 Apr; 130(16):164309. PubMed ID: 19405581
    [TBL] [Abstract][Full Text] [Related]  

  • 19. Vibronic structure and ion core interactions in Rydberg states of diazomethane: an experimental and theoretical investigation.
    Fedorov I; Koziol L; Li G; Reisler H; Krylov AI
    J Phys Chem A; 2007 Dec; 111(51):13347-57. PubMed ID: 18052355
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Density functional theory calculations of the lowest energy quintet and triplet states of model hemes: role of functional, basis set, and zero-point energy corrections.
    Khvostichenko D; Choi A; Boulatov R
    J Phys Chem A; 2008 Apr; 112(16):3700-11. PubMed ID: 18348545
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 6.