BIOMARKERS

Molecular Biopsy of Human Tumors

- a resource for Precision Medicine *

393 related articles for article (PubMed ID: 25710893)

  • 1. HOMO-LUMO, UV, NLO, NMR and vibrational analysis of 3-methyl-1-phenylpyrazole using FT-IR, FT-RAMAN FT-NMR spectra and HF-DFT computational methods.
    Carthigayan K; Xavier S; Periandy S
    Spectrochim Acta A Mol Biomol Spectrosc; 2015 May; 142():350-63. PubMed ID: 25710893
    [TBL] [Abstract][Full Text] [Related]  

  • 2. Spectroscopic (FT-IR, FT-Raman, UV and NMR) investigation on 1-phenyl-2-nitropropene by quantum computational calculations.
    Xavier S; Periandy S
    Spectrochim Acta A Mol Biomol Spectrosc; 2015; 149():216-30. PubMed ID: 25965169
    [TBL] [Abstract][Full Text] [Related]  

  • 3. NBO, conformational, NLO, HOMO-LUMO, NMR and electronic spectral study on 1-phenyl-1-propanol by quantum computational methods.
    Xavier S; Periandy S; Ramalingam S
    Spectrochim Acta A Mol Biomol Spectrosc; 2015 Feb; 137():306-20. PubMed ID: 25228039
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Spectroscopic studies (FTIR, FT-Raman and UV-Visible), normal coordinate analysis, NBO analysis, first order hyper polarizability, HOMO and LUMO analysis of (1R)-N-(Prop-2-yn-1-yl)-2,3-dihydro-1H-inden-1-amine molecule by ab initio HF and density functional methods.
    Muthu S; Ramachandran G
    Spectrochim Acta A Mol Biomol Spectrosc; 2014; 121():394-403. PubMed ID: 24280302
    [TBL] [Abstract][Full Text] [Related]  

  • 5. FTIR, FT-RAMAN, NMR, spectra, normal co-ordinate analysis, NBO, NLO and DFT calculation of N,N-diethyl-4-methylpiperazine-1-carboxamide molecule.
    Muthu S; Elamurugu Porchelvi E
    Spectrochim Acta A Mol Biomol Spectrosc; 2013 Nov; 115():275-86. PubMed ID: 23845985
    [TBL] [Abstract][Full Text] [Related]  

  • 6. 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]  

  • 7. 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]  

  • 8. FT-IR, FT-Raman, NMR studies and ab initio-HF, DFT-B3LYP vibrational analysis of 4-chloro-2-fluoroaniline.
    Arivazhagan M; Anitha Rexalin D
    Spectrochim Acta A Mol Biomol Spectrosc; 2012 Oct; 96():668-76. PubMed ID: 22885079
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Vibrational spectra, monomer, dimer, NBO, HOMO, LUMO and NMR analyses of trans-4-hydroxy-L-proline.
    Xavier RJ; Dinesh P
    Spectrochim Acta A Mol Biomol Spectrosc; 2014 Jul; 128():54-68. PubMed ID: 24657468
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Experimental and theoretical (FT-IR, FT-Raman, UV-vis, NMR) spectroscopic analysis and first order hyperpolarizability studies of non-linear optical material: (2E)-3-[4-(methylsulfanyl) phenyl]-1-(4-nitrophenyl) prop-2-en-1-one using density functional theory.
    Kumar A; Deval V; Tandon P; Gupta A; Deepak D'silva E
    Spectrochim Acta A Mol Biomol Spectrosc; 2014 Sep; 130():41-53. PubMed ID: 24762572
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Spectroscopic (FT-IR/FT-Raman) and computational (HF/DFT) investigation and HOMO/LUMO/MEP analysis on 2-amino-4-chlorophenol.
    Ramalingam S; Periandy S; Karabacak M; Karthikeyan N
    Spectrochim Acta A Mol Biomol Spectrosc; 2013 Mar; 104():337-51. PubMed ID: 23274261
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Synthesis, molecular conformation, vibrational and electronic transition, isometric chemical shift, polarizability and hyperpolarizability analysis of 3-(4-methoxy-phenyl)-2-(4-nitro-phenyl)-acrylonitrile: a combined experimental and theoretical analysis.
    Asiri AM; Karabacak M; Kurt M; Alamry KA
    Spectrochim Acta A Mol Biomol Spectrosc; 2011 Nov; 82(1):444-55. PubMed ID: 21856218
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Conformational analysis, spectroscopic study (FT-IR, FT-Raman, UV, 1H and 13C NMR), molecular orbital energy and NLO properties of 5-iodosalicylic acid.
    Karaca C; Atac A; Karabacak M
    Spectrochim Acta A Mol Biomol Spectrosc; 2015 Feb; 136 Pt B():295-305. PubMed ID: 25448933
    [TBL] [Abstract][Full Text] [Related]  

  • 14. DFT calculations and experimental FT-IR, FT-Raman, NMR, UV-Vis spectral studies of 3-fluorophenylboronic acid.
    Karabacak M; Kose E; Sas EB; Kurt M; Asiri AM; Atac A
    Spectrochim Acta A Mol Biomol Spectrosc; 2015 Feb; 136 Pt B():306-20. PubMed ID: 25448934
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Molecular structure, vibrational spectra, natural bond orbital and thermodynamic analysis of 3,6-dichloro-4-methylpyridazine and 3,6-dichloropyridazine-4-carboxylic acid by dft approach.
    Prabavathi N; Senthil Nayaki N; Venkatram Reddy B
    Spectrochim Acta A Mol Biomol Spectrosc; 2015 Feb; 136 Pt B():1134-48. PubMed ID: 25459510
    [TBL] [Abstract][Full Text] [Related]  

  • 16. NBO, HOMO-LUMO, UV, NLO, NMR and vibrational analysis of veratrole using FT-IR, FT-Raman, FT-NMR spectra and HF-DFT computational methods.
    Suvitha A; Periandy S; Gayathri P
    Spectrochim Acta A Mol Biomol Spectrosc; 2015 Mar; 138():357-69. PubMed ID: 25514662
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Synthesis, spectroscopic (FT-IR, FT-Raman, UV and NMR) and computational studies on 3t-pentyl-2r,6c-diphenylpiperidin-4-one semicarbazone.
    Arockia doss M; Savithiri S; Rajarajan G; Thanikachalam V; Saleem H
    Spectrochim Acta A Mol Biomol Spectrosc; 2015 Sep; 148():189-202. PubMed ID: 25879989
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Spectroscopic (FT-IR, FT-Raman, UV and NMR) investigation, conformational stability, NLO properties, HOMO-LUMO and NBO analysis of hydroxyquinoline derivatives by density functional theory calculations.
    Prabavathi N; Nilufer A; Krishnakumar V
    Spectrochim Acta A Mol Biomol Spectrosc; 2013 Oct; 114():449-74. PubMed ID: 23792240
    [TBL] [Abstract][Full Text] [Related]  

  • 19. The spectroscopic (FT-Raman, FT-IR, UV and NMR), molecular electrostatic potential, polarizability and hyperpolarizability, NBO and HOMO-LUMO analysis of monomeric and dimeric structures of 4-chloro-3,5-dinitrobenzoic acid.
    Karabacak M; Sinha L; Prasad O; Cinar Z; Cinar M
    Spectrochim Acta A Mol Biomol Spectrosc; 2012 Jul; 93():33-46. PubMed ID: 22465765
    [TBL] [Abstract][Full Text] [Related]  

  • 20. FT-IR, FT-Raman, NMR and UV-Vis spectra and DFT calculations of 5-bromo-2-ethoxyphenylboronic acid (monomer and dimer structures).
    Sas EB; Kose E; Kurt M; Karabacak M
    Spectrochim Acta A Mol Biomol Spectrosc; 2015 Feb; 137():1315-33. PubMed ID: 25305625
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 20.