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 *

104 related articles for article (PubMed ID: 25319050)

  • 1. A combined MD/QM and experimental exploration of conformational richness in branched oligothiophenes.
    Sjöqvist J; González-Cano RC; López Navarrete JT; Casado J; Ruiz Delgado MC; Linares M; Norman P
    Phys Chem Chem Phys; 2014 Dec; 16(45):24841-52. PubMed ID: 25319050
    [TBL] [Abstract][Full Text] [Related]  

  • 2. Toward a molecular understanding of the detection of amyloid proteins with flexible conjugated oligothiophenes.
    Sjöqvist J; Maria J; Simon RA; Linares M; Norman P; Nilsson KP; Lindgren M
    J Phys Chem A; 2014 Oct; 118(42):9820-7. PubMed ID: 25247879
    [TBL] [Abstract][Full Text] [Related]  

  • 3. Molecular structure investigation and spectroscopic studies on 2,3-difluorophenylboronic acid: a combined experimental and theoretical analysis.
    Karabacak M; Kose E; Atac A; Ali Cipiloglu M; Kurt M
    Spectrochim Acta A Mol Biomol Spectrosc; 2012 Nov; 97():892-908. PubMed ID: 22902933
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Experimental, theoretical calculations of the vibrational spectra and conformational analysis of 2,4-di-tert-butylphenol.
    Kalaichelvan S; Sundaraganesan N; Dereli O; Sayin U
    Spectrochim Acta A Mol Biomol Spectrosc; 2012 Jan; 85(1):198-209. PubMed ID: 22020168
    [TBL] [Abstract][Full Text] [Related]  

  • 5. Vibrational circular dichroism and IR spectral analysis as a test of theoretical conformational modeling for a cyclic hexapeptide.
    Bour P; Kim J; Kapitan J; Hammer RP; Huang R; Wu L; Keiderling TA
    Chirality; 2008 Nov; 20(10):1104-19. PubMed ID: 18506832
    [TBL] [Abstract][Full Text] [Related]  

  • 6. Synthesis, crystal structure, vibrational spectroscopy, optical properties and theoretical studies of a new organic-inorganic hybrid material: [((CH3)2NH2)(+)]6·[(BiBr6)(3-)]2.
    Ben Ahmed A; Feki H; Abid Y
    Spectrochim Acta A Mol Biomol Spectrosc; 2014 Dec; 133():357-64. PubMed ID: 24967541
    [TBL] [Abstract][Full Text] [Related]  

  • 7. 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]  

  • 8. Axial chirality of donor-donor, donor-acceptor, and tethered 1,1'-binaphthyls: a theoretical revisit with dynamics trajectories.
    Nishizaka M; Mori T; Inoue Y
    J Phys Chem A; 2011 Jun; 115(21):5488-95. PubMed ID: 21557592
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Classical and quantum mechanical/molecular mechanical molecular dynamics simulations of alanine dipeptide in water: comparisons with IR and vibrational circular dichroism spectra.
    Kwac K; Lee KK; Han JB; Oh KI; Cho M
    J Chem Phys; 2008 Mar; 128(10):105106. PubMed ID: 18345930
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Direct calculations of vibrational absorption and circular dichroism spectra of alanine dipeptide analog in water: quantum mechanical/molecular mechanical molecular dynamics simulations.
    Yang S; Cho M
    J Chem Phys; 2009 Oct; 131(13):135102. PubMed ID: 19814574
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Molecular structure, vibrational spectra, NMR and UV spectral analysis of sulfamethoxazole.
    Vijaya Chamundeeswari SP; James Jebaseelan Samuel E; Sundaraganesan N
    Spectrochim Acta A Mol Biomol Spectrosc; 2014 Jan; 118():1-10. PubMed ID: 24036090
    [TBL] [Abstract][Full Text] [Related]  

  • 12. NMR, UV, FT-IR, FT-Raman spectra and molecular structure (monomeric and dimeric structures) investigation of nicotinic acid N-oxide: A combined experimental and theoretical study.
    Atac A; Karabacak M; Karaca C; Kose E
    Spectrochim Acta A Mol Biomol Spectrosc; 2012 Jan; 85(1):145-54. PubMed ID: 22001008
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Experimental and theoretical investigation of the molecular structure, conformational stability, hyperpolarizability, electrostatic potential, thermodynamic properties and NMR spectra of pharmaceutical important molecule: 4'-methylpropiophenone.
    Karunakaran V; Balachandran V
    Spectrochim Acta A Mol Biomol Spectrosc; 2014 Jul; 128():1-14. PubMed ID: 24657464
    [TBL] [Abstract][Full Text] [Related]  

  • 14. 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]  

  • 15. Infrared optical activity: electric field approaches in time domain.
    Rhee H; Choi JH; Cho M
    Acc Chem Res; 2010 Dec; 43(12):1527-36. PubMed ID: 20931956
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Simulation of infrared spectra for beta-hairpin peptides stabilized by an Aib-Gly turn sequence: correlation between conformational fluctuation and vibrational coupling.
    Kim J; Huang R; Kubelka J; Bou Rcaron P; Keiderling TA
    J Phys Chem B; 2006 Nov; 110(46):23590-602. PubMed ID: 17107215
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Molecular structure, spectroscopic characterization (FT-IR, FT-Raman, UV and NMR), HOMO and LUMO analysis of 3-ethynylthiophene with DFT quantum chemical calculations.
    Karabacak M; Bilgili S; Mavis T; Eskici M; Atac A
    Spectrochim Acta A Mol Biomol Spectrosc; 2013 Nov; 115():709-18. PubMed ID: 23886506
    [TBL] [Abstract][Full Text] [Related]  

  • 18. QM/MM-MD simulations of conjugated polyelectrolytes: a study of luminescent conjugated oligothiophenes for use as biophysical probes.
    Sjöqvist J; Linares M; Mikkelsen KV; Norman P
    J Phys Chem A; 2014 May; 118(19):3419-28. PubMed ID: 24738472
    [TBL] [Abstract][Full Text] [Related]  

  • 19. FT-IR and FT-Raman spectroscopic investigation, computed vibrational frequency analysis and IR intensity and Raman activity peak resemblance analysis on 2-nitroanisole using HF and DFT (B3LYP and B3PW91) calculations.
    Prabhu T; Periandy S; Ramalingam S
    Spectrochim Acta A Mol Biomol Spectrosc; 2011 Dec; 83(1):8-16. PubMed ID: 21963192
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Raman spectra of the phycoviolobilin cofactor in phycoerythrocyanin calculated by QM/MM methods.
    Mroginski MA; Kaminski S; Hildebrandt P
    Chemphyschem; 2010 Apr; 11(6):1265-74. PubMed ID: 20376872
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 6.