BIOMARKERS

Molecular Biopsy of Human Tumors

- a resource for Precision Medicine *

2678 related articles for article (PubMed ID: 25244296)

  • 1. FT-IR and Raman spectra, ab initio and density functional computations of the vibrational spectra, molecular geometries and atomic charges of uracil and 5-methyluracil (thymine).
    Singh JS
    Spectrochim Acta A Mol Biomol Spectrosc; 2015 Feb; 137():625-40. PubMed ID: 25244296
    [TBL] [Abstract][Full Text] [Related]  

  • 2. IR and Raman spectra, ab initio and density functional computations of the vibrational spectra, molecular geometries and atomic charges of uracil and 5-aminouracil.
    Singh JS
    Spectrochim Acta A Mol Biomol Spectrosc; 2014 Sep; 130():313-28. PubMed ID: 24793482
    [TBL] [Abstract][Full Text] [Related]  

  • 3. 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]  

  • 4. FTIR and Raman spectra and fundamental frequencies of 5-halosubstituted uracils: 5-X-uracil (X=F, Cl, Br and I).
    Singh JS
    Spectrochim Acta A Mol Biomol Spectrosc; 2012 Feb; 87():106-11. PubMed ID: 22169026
    [TBL] [Abstract][Full Text] [Related]  

  • 5. FTIR and raman spectra compared with ab initio calculated frequency modes for 5-aminouracil.
    Singh JS
    J Biol Phys; 2008 Dec; 34(6):569-76. PubMed ID: 19669514
    [TBL] [Abstract][Full Text] [Related]  

  • 6. FT-IR and FT-Raman, vibrational assignments, molecular geometry, ab initio (HF) and DFT (B3LYP) calculations for 1,3-dichlorobenzene.
    Mahadevan D; Periandy S; Ramalingam S
    Spectrochim Acta A Mol Biomol Spectrosc; 2011 Sep; 79(5):962-9. PubMed ID: 21561799
    [TBL] [Abstract][Full Text] [Related]  

  • 7. Ab initio HF and DFT simulations, FT-IR and FT-Raman vibrational analysis of alpha-chlorotoluene.
    Nagabalasubramanian PB; Periandy S; Mohan S
    Spectrochim Acta A Mol Biomol Spectrosc; 2010 Sep; 77(1):150-9. PubMed ID: 20537941
    [TBL] [Abstract][Full Text] [Related]  

  • 8. FTIR and FT-Raman spectra, assignments, ab initio HF and DFT analysis of xanthine.
    Arivazhagan M; Jeyavijayan S
    Spectrochim Acta A Mol Biomol Spectrosc; 2011 Jun; 79(1):161-8. PubMed ID: 21450515
    [TBL] [Abstract][Full Text] [Related]  

  • 9. FTIR and FT Raman, molecular geometry, vibrational assignments, ab initio and density functional theory calculations for 1,5-methylnaphthalene.
    Nagabalasubramanian PB; Periandy S
    Spectrochim Acta A Mol Biomol Spectrosc; 2010 Dec; 77(5):1099-107. PubMed ID: 20933463
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Raman and IR studies and DFT calculations of the vibrational spectra of 2,4-Dithiouracil and its cation and anion.
    Singh R; Yadav RA
    Spectrochim Acta A Mol Biomol Spectrosc; 2014 Sep; 130():188-97. PubMed ID: 24785092
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Density functional theory study on the structure and vibrational frequencies of glycylglycine.
    Zhao B; Wang C; Zhao S; Qin M; Zhou Z; Sun Y
    Spectrochim Acta A Mol Biomol Spectrosc; 2008 Jul; 70(2):301-6. PubMed ID: 17919969
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Revised vibrational band assignments for the experimental IR and Raman spectra of 2,3,4-trifluorobenzonitrile based on ab initio, DFT and normal coordinate calculations.
    Hiremath CS; Kalkoti GB; Aralakkanavar MK
    Spectrochim Acta A Mol Biomol Spectrosc; 2009 Sep; 74(1):200-4. PubMed ID: 19560961
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Molecular structure, IR spectra of 2-mercaptobenzothiazole and 2-mercaptobenzoxazole by density functional theory and ab initio Hartree-Fock calculations.
    Li XH; Tang ZX; Zhang XZ
    Spectrochim Acta A Mol Biomol Spectrosc; 2009 Sep; 74(1):168-73. PubMed ID: 19553157
    [TBL] [Abstract][Full Text] [Related]  

  • 14. Quantum chemical studies on structure of 2-amino-5-nitropyrimidine.
    Arivazhagan M; Subhasini VP
    Spectrochim Acta A Mol Biomol Spectrosc; 2012 Jun; 91():402-10. PubMed ID: 22402480
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Vibrational analysis of 4-amino pyrazolo (3,4-d) pyrimidine A joint FTIR, Laser Raman and scaled quantum mechanical studies.
    Arivazhagan M; Senthil kumar J
    Spectrochim Acta A Mol Biomol Spectrosc; 2011 Nov; 82(1):228-34. PubMed ID: 21824808
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Molecular and vibrational structure of 2-mercapto pyrimidine and 2,4-diamino-6-hydroxy-5-nitroso pyrimidine: FT-IR, FT-Raman and quantum chemical calculations.
    Krishnakumar V; John Xavier R
    Spectrochim Acta A Mol Biomol Spectrosc; 2006 Feb; 63(2):454-63. PubMed ID: 15990356
    [TBL] [Abstract][Full Text] [Related]  

  • 17. A scaled quantum mechanical approach of vibrational analysis of o-tolunitrile based on FTIR and FT Raman spectra, ab initio, Hartree Fock and DFT methods.
    Nagabalasubramanian PB; Periandy S; Mohan S
    Spectrochim Acta A Mol Biomol Spectrosc; 2009 Dec; 74(5):1280-7. PubMed ID: 19875327
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Effect of intermolecular hydrogen bonding, vibrational analysis and molecular structure of 4-chlorobenzothioamide.
    Çırak Ç; Sert Y; Ucun F
    Spectrochim Acta A Mol Biomol Spectrosc; 2013 Sep; 113():130-6. PubMed ID: 23714189
    [TBL] [Abstract][Full Text] [Related]  

  • 19. FTIR and FT-Raman spectra, molecular geometry, vibrational assignments, first-order hyperpolarizability, ab initio and DFT calculations for 3,4-dimethoxybenzonitrile.
    Jeyavijayan S; Arivazhagan M
    Spectrochim Acta A Mol Biomol Spectrosc; 2011 Oct; 81(1):466-74. PubMed ID: 21752703
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Vibrational spectroscopic (FT-IR and FT-Raman), first-order hyperpolarizablity, HOMO, LUMO, NBO, Mulliken charges and structure determination of 2-bromo-4-chlorotoluene.
    Arunagiri C; Arivazhagan M; Subashini A
    Spectrochim Acta A Mol Biomol Spectrosc; 2011 Sep; 79(5):1747-56. PubMed ID: 21680229
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 134.