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 *

110 related articles for article (PubMed ID: 18020433)

  • 1. Hf3 cluster is triply (sigma-, pi-, and delta-) aromatic in the lowest D3h, 1A1' state.
    Averkiev BB; Boldyrev AI
    J Phys Chem A; 2007 Dec; 111(50):12864-6. PubMed ID: 18020433
    [TBL] [Abstract][Full Text] [Related]  

  • 2. High-accuracy calculations of the ground, 1 1A1', and the 2 1A1', 2 3A1', and 1 1E' excited states of H3+.
    Pavanello M; Adamowicz L
    J Chem Phys; 2009 Jan; 130(3):034104. PubMed ID: 19173507
    [TBL] [Abstract][Full Text] [Related]  

  • 3. Ab initio study of the spectroscopy of AgBr: a CASSCF + Averaged Coupled Pair Functional approach to the lowest excited states including spin-orbit couplings.
    Amaro-Estrada JI; Ramírez-Solís A
    J Chem Phys; 2009 Sep; 131(12):124308. PubMed ID: 19791882
    [TBL] [Abstract][Full Text] [Related]  

  • 4. 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]  

  • 5. Homonuclear transition-metal trimers.
    Papas BN; Schaefer HF
    J Chem Phys; 2005 Aug; 123(7):074321. PubMed ID: 16229584
    [TBL] [Abstract][Full Text] [Related]  

  • 6. Ab initio study of the mechanism for photoinduced Yl-oxygen exchange in uranyl(VI) in acidic aqueous solution.
    Réal F; Vallet V; Wahlgren U; Grenthe I
    J Am Chem Soc; 2008 Sep; 130(35):11742-51. PubMed ID: 18686948
    [TBL] [Abstract][Full Text] [Related]  

  • 7. A quantum chemistry study: a new kind of boron nitrides.
    Li QS; Xu Y
    J Comput Chem; 2007 Jun; 28(8):1446-55. PubMed ID: 17330881
    [TBL] [Abstract][Full Text] [Related]  

  • 8. A combined ab initio and Franck-Condon factor simulation study on the photodetachment spectrum of HfO2-.
    Mok DK; Lee EP; Chau FT; Dyke JM
    Phys Chem Chem Phys; 2008 Dec; 10(48):7270-7. PubMed ID: 19060972
    [TBL] [Abstract][Full Text] [Related]  

  • 9. A computational study on the mechanism of intramolecular oxo-hydroxy phototautomerism driven by repulsive pi sigma* state.
    Chmura B; Rode MF; Sobolewski AL; Lapinski L; Nowak MJ
    J Phys Chem A; 2008 Dec; 112(51):13655-61. PubMed ID: 19061324
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Theoretical investigation of anthracene-9,10-endoperoxide vertical singlet and triplet excitation spectra.
    Corral I; González L
    J Comput Chem; 2008 Sep; 29(12):1982-91. PubMed ID: 18366030
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Triplet-state aromaticity of 4npi-electron monocycles: analysis of bifurcation in the pi contribution to the electron localization function.
    Villaume S; Fogarty HA; Ottosson H
    Chemphyschem; 2008 Feb; 9(2):257-64. PubMed ID: 18200480
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Excited states of thiophene: ring opening as deactivation mechanism.
    Salzmann S; Kleinschmidt M; Tatchen J; Weinkauf R; Marian CM
    Phys Chem Chem Phys; 2008 Jan; 10(3):380-92. PubMed ID: 18174980
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Theoretical study of hydrogenation of the doubly aromatic B7- cluster.
    Alexandrova AN; Koyle E; Boldyrev AI
    J Mol Model; 2006 Jul; 12(5):569-76. PubMed ID: 16261298
    [TBL] [Abstract][Full Text] [Related]  

  • 14. Negative ion photoelectron spectroscopy confirms the prediction that
    Hrovat DA; Hou GL; Chen B; Wang XB; Borden WT
    Chem Sci; 2016 Feb; 7(2):1142-1150. PubMed ID: 29910870
    [TBL] [Abstract][Full Text] [Related]  

  • 15. First principles study of the electronic structure and bonding of Mn2.
    Tzeli D; Miranda U; Kaplan IG; Mavridis A
    J Chem Phys; 2008 Oct; 129(15):154310. PubMed ID: 19045196
    [TBL] [Abstract][Full Text] [Related]  

  • 16. A theoretical study on the thermal ring opening rearrangement of 1H-bicyclo[3.1.0]hexa-3,5-dien-2-one: a case of two state reactivity.
    González-Navarrete P; Coto PB; Polo V; Andrés J
    Phys Chem Chem Phys; 2009 Sep; 11(33):7189-96. PubMed ID: 19672528
    [TBL] [Abstract][Full Text] [Related]  

  • 17. DFT/TDDFT exploration of the potential energy surfaces of the ground state and excited states of Fe2(S2C3H6)(CO)6: a simple functional model of the [FeFe] hydrogenase active site.
    Bertini L; Greco C; De Gioia L; Fantucci P
    J Phys Chem A; 2009 May; 113(19):5657-70. PubMed ID: 19378958
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Theoretical study of pyrazolate-bridged dinuclear platinum(II) complexes: interesting potential energy curve of the lowest energy triplet excited state and phosphorescence spectra.
    Saito K; Nakao Y; Sakaki S
    Inorg Chem; 2008 May; 47(10):4329-37. PubMed ID: 18416550
    [TBL] [Abstract][Full Text] [Related]  

  • 19. Singlet and triplet excited states and intersystem crossing in free-base porphyrin: TDDFT and DFT/MRCI study.
    Perun S; Tatchen J; Marian CM
    Chemphyschem; 2008 Feb; 9(2):282-92. PubMed ID: 18189251
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Structure and stability of the [TCNE](2)(2-) dimers in dichloromethane solution: a computational study.
    Garcia-Yoldi I; Miller JS; Novoa JJ
    J Phys Chem A; 2007 Aug; 111(32):8020-7. PubMed ID: 17628054
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 6.