BIOMARKERS

Molecular Biopsy of Human Tumors

- a resource for Precision Medicine *

1062 related articles for article (PubMed ID: 21183400)

  • 1. Molecular structure and vibrational analysis of 3-Ethylpyridine using ab initio HF and density functional theory (B3LYP) calculations.
    Shakila G; Periandy S; Ramalingam S
    Spectrochim Acta A Mol Biomol Spectrosc; 2011 Feb; 78(2):732-9. PubMed ID: 21183400
    [TBL] [Abstract][Full Text] [Related]  

  • 2. Vibrational spectroscopic (FTIR and FTRaman) investigation using ab initio (HF) and DFT (LSDA and B3LYP) analysis on the structure of Toluic acid.
    Babu PD; Periandy S; Ramalingam S
    Spectrochim Acta A Mol Biomol Spectrosc; 2011 Apr; 78(4):1321-8. PubMed ID: 21273116
    [TBL] [Abstract][Full Text] [Related]  

  • 3. Molecular structure and vibrational investigation of benzenesulfonic acid methyl ester using DFT (LSDA, B3LYP, B3PW91 and MPW1PW91) theory calculations.
    Babu PD; Periandy S; Mohan S; Ramalingam S; Jayaprakash BG
    Spectrochim Acta A Mol Biomol Spectrosc; 2011 Jan; 78(1):168-78. PubMed ID: 20943432
    [TBL] [Abstract][Full Text] [Related]  

  • 4. FT-IR and FT-Raman spectra and vibrational investigation of 4-chloro-2-fluoro toluene using ab initio HF and DFT (B3LYP/B3PW91) calculations.
    Ramalingam S; Periandy S; Elanchezhian B; Mohan S
    Spectrochim Acta A Mol Biomol Spectrosc; 2011 Jan; 78(1):429-36. PubMed ID: 21146451
    [TBL] [Abstract][Full Text] [Related]  

  • 5. FT-IR, FT-Raman spectra and ab initio HF, DFT vibrational analysis of p-chlorobenzoic acid.
    Sundaraganesan N; Anand B; Meganathan C; Joshua BD
    Spectrochim Acta A Mol Biomol Spectrosc; 2008 Mar; 69(3):871-9. PubMed ID: 17658292
    [TBL] [Abstract][Full Text] [Related]  

  • 6. Vibrational spectroscopic investigation (FT-IR and FT-Raman) on 1,2-dibromobenzene by HF and hybrid (LSDA and B3LYP) calculations.
    Shakila G; Periandy S; Ramalingam S
    Spectrochim Acta A Mol Biomol Spectrosc; 2012 Feb; 86():449-55. PubMed ID: 22112581
    [TBL] [Abstract][Full Text] [Related]  

  • 7. FT-IR and FT-Raman spectral investigation, computed IR intensity and Raman activity analysis and frequency estimation analysis on 4-chloro-2-bromoacetophenone using HF and DFT calculations.
    Ramalingam S; Anbusrinivasan P; Periandy S
    Spectrochim Acta A Mol Biomol Spectrosc; 2011 Feb; 78(2):826-34. PubMed ID: 21216662
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Vibrational spectroscopy [FTIR and FTRaman] investigation, computed vibrational frequency analysis and IR intensity and Raman activity peak resemblance analysis on 4-chloro 2-methylaniline using HF and DFT [LSDA, B3LYP and B3PW91] calculations.
    Ramalingam S; Periandy S
    Spectrochim Acta A Mol Biomol Spectrosc; 2011 Mar; 78(3):1149-61. PubMed ID: 21237700
    [TBL] [Abstract][Full Text] [Related]  

  • 9. FT-IR and FT-Raman vibrational spectra and molecular structure investigation of nicotinamide: A combined experimental and theoretical study.
    Ramalingam S; Periandy S; Govindarajan M; Mohan S
    Spectrochim Acta A Mol Biomol Spectrosc; 2010 May; 75(5):1552-8. PubMed ID: 20227335
    [TBL] [Abstract][Full Text] [Related]  

  • 10. FT-IR, FT-Raman spectra and ab initio HF and DFT calculations of 4-N,N'-dimethylamino pyridine.
    Sundaraganesan N; Kalaichelvan S; Meganathan C; Joshua BD; Cornard J
    Spectrochim Acta A Mol Biomol Spectrosc; 2008 Dec; 71(3):898-906. PubMed ID: 18358770
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Spectroscopic (FTIR and FT Raman) analysis and vibrational study on 2,3-dimethyl naphthalene using ab-initio HF and DFT calculations.
    Prabhu T; Periandy S; Mohan S
    Spectrochim Acta A Mol Biomol Spectrosc; 2011 Feb; 78(2):566-74. PubMed ID: 21185771
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Vibrational spectroscopy (FTIR and FTRaman) investigation using ab initio (HF) and DFT (B3LYP) calculations on the structure of 3-Bromo phenol.
    Mahadevan D; Periandy S; Ramalingam S
    Spectrochim Acta A Mol Biomol Spectrosc; 2011 Feb; 78(2):575-81. PubMed ID: 21185772
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Spectroscopic investigation, computed IR intensity, Raman activity and vibrational frequency analysis on 3-bromoanisole using HF and DFT (LSDA/MPW1PW91) calculations.
    Ramalingam S; Periandy S
    Spectrochim Acta A Mol Biomol Spectrosc; 2011 Feb; 78(2):835-43. PubMed ID: 21216183
    [TBL] [Abstract][Full Text] [Related]  

  • 14. Experimental (FT-IR and FT-Raman) and theoretical (HF and DFT) investigation, IR intensity, Raman activity and frequency estimation analyses on 1-bromo-4-chlorobenzene.
    Udayakumar V; Periandy S; Ramalingam S
    Spectrochim Acta A Mol Biomol Spectrosc; 2011 Sep; 79(5):920-7. PubMed ID: 21550298
    [TBL] [Abstract][Full Text] [Related]  

  • 15. FT-IR, FT-Raman spectra and quantum chemical calculations of 3,4-dimethoxyaniline.
    Sundaraganesan N; Priya M; Meganathan C; Joshua BD; Cornard JP
    Spectrochim Acta A Mol Biomol Spectrosc; 2008 Jun; 70(1):50-9. PubMed ID: 17765601
    [TBL] [Abstract][Full Text] [Related]  

  • 16. FT-IR, FT-Raman spectra and quantum chemical calculations of some chloro substituted phenoxy acetic acids.
    Sundaraganesan N; Meganathan C; Karthikeyan B
    Spectrochim Acta A Mol Biomol Spectrosc; 2008 Jul; 70(2):430-8. PubMed ID: 18282793
    [TBL] [Abstract][Full Text] [Related]  

  • 17. FT-IR, FT-Raman spectra and ab initio HF, DFT vibrational analysis of 2,3-difluoro phenol.
    Sundaraganesan N; Anand B; Meganathan C; Joshua BD
    Spectrochim Acta A Mol Biomol Spectrosc; 2007 Nov; 68(3):561-6. PubMed ID: 17324616
    [TBL] [Abstract][Full Text] [Related]  

  • 18. FT-IR, FT-Raman, ab initio and DFT structural and vibrational frequency analysis of 6-aminopenicillanic acid.
    Swaminathan J; Ramalingam M; Sethuraman V; Sundaraganesan N; Sebastian S; Kurt M
    Spectrochim Acta A Mol Biomol Spectrosc; 2010 Jan; 75(1):183-90. PubMed ID: 19897407
    [TBL] [Abstract][Full Text] [Related]  

  • 19. DFT simulations and vibrational analysis of FT-IR and FT-Raman spectra of 2,4-diamino-6-hydroxypyrimidine.
    Subramanian MK; Anbarasan PM; Manimegalai S
    Spectrochim Acta A Mol Biomol Spectrosc; 2009 Aug; 73(4):642-9. PubMed ID: 19406685
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Molecular structure and vibrational spectra of 3-chloro-4-fluoro benzonitrile by ab initio HF and density functional method.
    Sundaraganesan N; Meganathan C; Joshua BD; Mani P; Jayaprakash A
    Spectrochim Acta A Mol Biomol Spectrosc; 2008 Dec; 71(3):1134-9. PubMed ID: 18448383
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 54.