BIOMARKERS

Molecular Biopsy of Human Tumors

- a resource for Precision Medicine *

249 related articles for article (PubMed ID: 16920011)

  • 1. Density functional theory study of vibronic structure of the first absorption Qx band in free-base porphin.
    Minaev B; Wang YH; Wang CK; Luo Y; Agren H
    Spectrochim Acta A Mol Biomol Spectrosc; 2006 Oct; 65(2):308-23. PubMed ID: 16920011
    [TBL] [Abstract][Full Text] [Related]  

  • 2. Photodecay dynamics of octaethylporphine in the condensed phase explored via resonance Raman spectroscopy and density functional theory calculation.
    Yin J; Wan J; Xu J; Wang H; Zheng X
    Spectrochim Acta A Mol Biomol Spectrosc; 2011 May; 78(5):1416-23. PubMed ID: 21396881
    [TBL] [Abstract][Full Text] [Related]  

  • 3. Resonance Raman spectroscopy and density functional theory calculation study of photodecay dynamics of tetra(4-carboxyphenyl) porphyrin.
    Wan J; Wang H; Wu Z; Shun YC; Zheng X; Phillips DL
    Phys Chem Chem Phys; 2011 Jun; 13(21):10183-90. PubMed ID: 21503331
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Excited state structural dynamics and Herzberg-Teller coupling of tetraphenylporphine explored via resonance Raman spectroscopy and density functional theory calculation.
    Xu J; Wan J; Zhao Y; Lv M; Zheng X; Wang G; Wang H
    Spectrochim Acta A Mol Biomol Spectrosc; 2010 May; 75(5):1381-7. PubMed ID: 20172758
    [TBL] [Abstract][Full Text] [Related]  

  • 5. Structure and vibrations of glutathione studied by vibrational spectroscopy and density functional theory.
    Singh G; Dogra SD; Kaur S; Tripathi SK; Prakash S; Rai B; Saini GS
    Spectrochim Acta A Mol Biomol Spectrosc; 2015; 149():505-15. PubMed ID: 25978018
    [TBL] [Abstract][Full Text] [Related]  

  • 6. Quantum chemistry-based analysis of the vibrational spectra of five-coordinate metalloporphyrins [M(TPP)Cl].
    Paulat F; Praneeth VK; Näther C; Lehnert N
    Inorg Chem; 2006 Apr; 45(7):2835-56. PubMed ID: 16562940
    [TBL] [Abstract][Full Text] [Related]  

  • 7. Effective method for the computation of optical spectra of large molecules at finite temperature including the Duschinsky and Herzberg-Teller effect: the Qx band of porphyrin as a case study.
    Santoro F; Lami A; Improta R; Bloino J; Barone V
    J Chem Phys; 2008 Jun; 128(22):224311. PubMed ID: 18554017
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Nonplanar heme deformations and excited state displacements in nickel porphyrins detected by Raman spectroscopy at soret excitation.
    Huang Q; Medforth CJ; Schweitzer-Stenner R
    J Phys Chem A; 2005 Nov; 109(46):10493-502. PubMed ID: 16834304
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Symmetry properties of vibrational modes in mesoporphyrin IX dimethyl ester investigated by polarization-sensitive resonance Raman and CARS spectroscopy.
    Koster J; Popp J; Kiefer W; Schlücker S
    J Phys Chem A; 2006 Oct; 110(39):11252-9. PubMed ID: 17004734
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Computation and interpretation of vibrational spectra on the structure of Losartan using ab initio and Density Functional methods.
    Latha B; Gunasekaran S; Srinivasan S; Ramkumaar GR
    Spectrochim Acta A Mol Biomol Spectrosc; 2014 Nov; 132():375-86. PubMed ID: 24887499
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Influence of Duschinsky and Herzberg-Teller effects on S₀→ S₁ vibrationally resolved absorption spectra of several porphyrin-like compounds.
    Yang P; Qi D; You G; Shen W; Li M; He R
    J Chem Phys; 2014 Sep; 141(12):124304. PubMed ID: 25273434
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Experimental and theoretical quantum chemical investigations of 8-hydroxy-5-nitroquinoline.
    Arjunan V; Balamourougane PS; Kalaivani M; Raj A; Mohan S
    Spectrochim Acta A Mol Biomol Spectrosc; 2012 Oct; 96():506-16. PubMed ID: 22728969
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Molecular structure, vibrational analysis (FT-IR, FT-Raman), NMR, UV, NBO and HOMO-LUMO analysis of N,N-Diphenyl Formamide based on DFT calculations.
    Mathammal R; Monisha NR; Yasaswini S; Krishnakumar V
    Spectrochim Acta A Mol Biomol Spectrosc; 2015 Mar; 139():521-32. PubMed ID: 25579654
    [TBL] [Abstract][Full Text] [Related]  

  • 14. Experimental and DFT studies on the vibrational and electronic spectra of 9-p-tolyl-9H-carbazole-3-carbaldehyde.
    Wang Y; Zhang Y; Ni H; Meng N; Ma K; Zhao J; Zhu D
    Spectrochim Acta A Mol Biomol Spectrosc; 2015 Jan; 135():296-306. PubMed ID: 25078462
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Density functional theory studies on the electronic and vibrational spectra of octaethylporphyrin diacid.
    Li ZY; Wang HL; Lu TT; He TJ; Liu FC; Chen DM
    Spectrochim Acta A Mol Biomol Spectrosc; 2007 Aug; 67(5):1382-91. PubMed ID: 17142087
    [TBL] [Abstract][Full Text] [Related]  

  • 16. FT-IR and Raman spectra, ab initio and density functional computations of the vibrational spectra, molecular geometries and atomic charges of uracil and 5-halogenated uracils (5-X-uracils; X=F, Cl, Br, I).
    Singh JS
    Spectrochim Acta A Mol Biomol Spectrosc; 2014 Jan; 117():502-18. PubMed ID: 24036044
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Spectroscopic (infrared, Raman, UV and NMR) analysis, Gaussian hybrid computational investigation (MEP maps/HOMO and LUMO) on cyclohexanone oxime.
    Ramalingam S; Karabacak M; Periandy S; Puviarasan N; Tanuja D
    Spectrochim Acta A Mol Biomol Spectrosc; 2012 Oct; 96():207-20. PubMed ID: 22683556
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Single site electronic spectra of free base porphin in an n-octane crystal at 5 K.
    Huang WY; Van Riper E; Johnson LW
    Spectrochim Acta A Mol Biomol Spectrosc; 1997 Apr; 53A(4):589-94. PubMed ID: 9177040
    [TBL] [Abstract][Full Text] [Related]  

  • 19. What is the best DFT functional for vibronic calculations? A comparison of the calculated vibronic structure of the S1-S0 transition of phenylacetylene with cavity ringdown band intensities.
    Lopez GV; Chang CH; Johnson PM; Hall GE; Sears TJ; Markiewicz B; Milan M; Teslja A
    J Phys Chem A; 2012 Jun; 116(25):6750-8. PubMed ID: 22616733
    [TBL] [Abstract][Full Text] [Related]  

  • 20. S(1)<--S(0) transition of 2,3-benzofluorene at low temperatures in the gas phase.
    Staicu A; Rouillé G; Henning T; Huisken F; Pouladsaz D; Scholz R
    J Chem Phys; 2008 Aug; 129(7):074302. PubMed ID: 19044762
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 13.