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 *

128 related articles for article (PubMed ID: 17614527)

  • 1. Approaching the full set of energy levels of water.
    Maksyutenko P; Muenter JS; Zobov NF; Shirin SV; Polyansky OL; Rizzo TR; Boyarkin OV
    J Chem Phys; 2007 Jun; 126(24):241101. PubMed ID: 17614527
    [TBL] [Abstract][Full Text] [Related]  

  • 2. Potential energy surface for H2O((3)A(")) from accurate ab initio data with inclusion of long-range interactions.
    Brandão J; Mogo C; Silva BC
    J Chem Phys; 2004 Nov; 121(18):8861-8. PubMed ID: 15527349
    [TBL] [Abstract][Full Text] [Related]  

  • 3. State-to-state reaction probabilities for the H+O2(v,j)-->O+OH(v',j') reaction on three potential energy surfaces.
    Hankel M; Smith SC; Meijer AJ
    J Chem Phys; 2007 Aug; 127(6):064316. PubMed ID: 17705605
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Collisionally assisted spectroscopy of water from 27,000 to 34,000 cm(-1).
    Grechko M; Maksyutenko P; Zobov NF; Shirin SV; Polyansky OL; Rizzo TR; Boyarkin OV
    J Phys Chem A; 2008 Oct; 112(42):10539-45. PubMed ID: 18823107
    [TBL] [Abstract][Full Text] [Related]  

  • 5. Quantum energy flow and the kinetics of water shuttling between hydrogen bonding sites on trans-formanilide.
    Agbo JK; Leitner DM; Myshakin EM; Jordan KD
    J Chem Phys; 2007 Aug; 127(6):064315. PubMed ID: 17705604
    [TBL] [Abstract][Full Text] [Related]  

  • 6. Evaluation of surface composition of surface active water-alcohol type mixtures: a comparison of semiempirical models.
    Salonen M; Malila J; Napari I; Laaksonen A
    J Phys Chem B; 2005 Mar; 109(8):3472-9. PubMed ID: 16851381
    [TBL] [Abstract][Full Text] [Related]  

  • 7. Full configuration interaction potential energy curves for the X (1)Sigma(g) (+), B (1)Delta(g), and B(') (1)Sigma(g) (+) states of C(2): a challenge for approximate methods.
    Abrams ML; Sherrill CD
    J Chem Phys; 2004 Nov; 121(19):9211-9. PubMed ID: 15538841
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Hydration free energies of monovalent ions in transferable intermolecular potential four point fluctuating charge water: an assessment of simulation methodology and force field performance and transferability.
    Warren GL; Patel S
    J Chem Phys; 2007 Aug; 127(6):064509. PubMed ID: 17705614
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Potential energy surface of HDO up to 25,000 cm-1.
    Yurchenko SN; Voronin BA; Tolchenov RN; Doss N; Naumenko OV; Thiel W; Tennyson J
    J Chem Phys; 2008 Jan; 128(4):044312. PubMed ID: 18247954
    [TBL] [Abstract][Full Text] [Related]  

  • 10. The limits of local correlation theory: electronic delocalization and chemically smooth potential energy surfaces.
    Subotnik JE; Sodt A; Head-Gordon M
    J Chem Phys; 2008 Jan; 128(3):034103. PubMed ID: 18205484
    [TBL] [Abstract][Full Text] [Related]  

  • 11. The photodissociation of ozone in the Hartley band: a theoretical analysis.
    Qu ZW; Zhu H; Grebenshchikov SY; Schinke R
    J Chem Phys; 2005 Aug; 123(7):074305. PubMed ID: 16229568
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Vacuum ultraviolet (VUV) photoionization of small water clusters.
    Belau L; Wilson KR; Leone SR; Ahmed M
    J Phys Chem A; 2007 Oct; 111(40):10075-83. PubMed ID: 17715907
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Low-lying quartet electronic states of nitrogen dioxide.
    Bera PP; Yamaguchi Y; Schaefer HF
    J Chem Phys; 2007 Nov; 127(17):174303. PubMed ID: 17994814
    [TBL] [Abstract][Full Text] [Related]  

  • 14. Extrapolating to the one-electron basis-set limit in electronic structure calculations.
    Varandas AJ
    J Chem Phys; 2007 Jun; 126(24):244105. PubMed ID: 17614535
    [TBL] [Abstract][Full Text] [Related]  

  • 15. State-resolved spectroscopy of high vibrational levels of water up to the dissociative continuum.
    Maksyutenko P; Grechko M; Rizzo TR; Boyarkin OV
    Philos Trans A Math Phys Eng Sci; 2012 Jun; 370(1968):2710-27. PubMed ID: 22547240
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Exciton analysis in 2D electronic spectroscopy.
    Cho M; Vaswani HM; Brixner T; Stenger J; Fleming GR
    J Phys Chem B; 2005 Jun; 109(21):10542-56. PubMed ID: 16852278
    [TBL] [Abstract][Full Text] [Related]  

  • 17. A direct measurement of the dissociation energy of water.
    Maksyutenko P; Rizzo TR; Boyarkin OV
    J Chem Phys; 2006 Nov; 125(18):181101. PubMed ID: 17115729
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Free energy surfaces for the alpha(1 --> 4)-glycosidic linkage: implications for polysaccharide solution structure and dynamics.
    Kuttel MM; Naidoo KJ
    J Phys Chem B; 2005 Apr; 109(15):7468-74. PubMed ID: 16851857
    [TBL] [Abstract][Full Text] [Related]  

  • 19. New double many-body expansion potential energy surface for ground-state HCN from a multiproperty fit to accurate ab initio energies and rovibrational calculations.
    Varandas AJ; Rodrigues SP
    J Phys Chem A; 2006 Jan; 110(2):485-93. PubMed ID: 16405320
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Calculation of rovibrational energy states for water vapor using the symmetric top approximation in the Pade form.
    Voitsekhovskaya OK; Cherepanov VN; Kotov AA
    Spectrochim Acta A Mol Biomol Spectrosc; 2004 Apr; 60(5):1133-9. PubMed ID: 15084333
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 7.