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 *

116 related articles for article (PubMed ID: 29800890)

  • 1. Investigation of structural, electronic properties and docking calculations of some boron complexes with norfloxacin: A computational research.
    Sayin K; Karakaş D
    Spectrochim Acta A Mol Biomol Spectrosc; 2018 Sep; 202():276-283. PubMed ID: 29800890
    [TBL] [Abstract][Full Text] [Related]  

  • 2. Investigations of structural, spectral and electronic properties of enrofloxacin and boron complexes via quantum chemical calculation and molecular docking.
    Sayin K; Üngördü A
    Spectrochim Acta A Mol Biomol Spectrosc; 2019 Sep; 220():117102. PubMed ID: 31146207
    [TBL] [Abstract][Full Text] [Related]  

  • 3. The effects of fluorine substitution on the chemical properties and inhibitory capacity of Donepezil anti-Alzheimer drug; density functional theory and molecular docking calculations.
    Khosravan A; Marani S; Sadeghi Googheri MS
    J Mol Graph Model; 2017 Jan; 71():124-134. PubMed ID: 27914299
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Quantum mechanical and spectroscopic (FT-IR, FT-Raman) study, NBO analysis, HOMO-LUMO, first order hyperpolarizability and molecular docking study of methyl[(3R)-3-(2-methylphenoxy)-3-phenylpropyl]amine by density functional method.
    Kuruvilla TK; Prasana JC; Muthu S; George J; Mathew SA
    Spectrochim Acta A Mol Biomol Spectrosc; 2018 Jan; 188():382-393. PubMed ID: 28756257
    [TBL] [Abstract][Full Text] [Related]  

  • 5. Electronic [UV-Visible] and vibrational [FT-IR, FT-Raman] investigation and NMR-mass spectroscopic analysis of terephthalic acid using quantum Gaussian calculations.
    Karthikeyan N; Prince JJ; Ramalingam S; Periandy S
    Spectrochim Acta A Mol Biomol Spectrosc; 2015 Mar; 139():229-42. PubMed ID: 25561302
    [TBL] [Abstract][Full Text] [Related]  

  • 6. 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]  

  • 7. 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]  

  • 8. 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]  

  • 9. 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]  

  • 10. 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]  

  • 11. Insilico molecular modeling, docking and spectroscopic [FT-IR/FT-Raman/UV/NMR] analysis of Chlorfenson using computational calculations.
    Ramalingam S; Periandy S; Sugunakala S; Prabhu T; Bououdina M
    Spectrochim Acta A Mol Biomol Spectrosc; 2013 Nov; 115():118-35. PubMed ID: 23832220
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Spectroscopic (FT-IR, FT-Raman) investigations and quantum chemical calculations of 4-hydroxy-2-oxo-1,2-dihydroquinoline-7-carboxylic acid.
    Ulahannan RT; Panicker CY; Varghese HT; Van Alsenoy C; Musiol R; Jampilek J; Anto PL
    Spectrochim Acta A Mol Biomol Spectrosc; 2014; 121():404-14. PubMed ID: 24287049
    [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. Vibrational spectroscopic [FT-IR, FT-Raman] investigation on (2,4,5-Trichlorophenoxy) Acetic acid using computational [HF and DFT] analysis.
    Karthikeyan N; Joseph Prince J; Ramalingam S; Periandy S
    Spectrochim Acta A Mol Biomol Spectrosc; 2014 Apr; 124():165-77. PubMed ID: 24486865
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Vibrational spectroscopic, 1H NMR and quantum chemical computational study of 4-hydroxy-2-oxo-1,2-dihydroquinoline-8-carboxylic acid.
    Ulahannan RT; Panicker CY; Varghese HT; Van Alsenoy C; Musiol R; Jampilek J; Anto PL
    Spectrochim Acta A Mol Biomol Spectrosc; 2014; 121():445-56. PubMed ID: 24287054
    [TBL] [Abstract][Full Text] [Related]  

  • 16. The spectroscopic (FT-IR, FT-Raman, dispersive Raman and NMR) study of ethyl-6-chloronicotinate molecule by combined density functional theory.
    Karabacak M; Calisir Z; Kurt M; Kose E; Atac A
    Spectrochim Acta A Mol Biomol Spectrosc; 2016 Jan; 153():754-70. PubMed ID: 26483317
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Vibrational frequency analysis, FT-IR, FT-Raman, ab initio, HF and DFT studies, NBO, HOMO-LUMO and electronic structure calculations on pycolinaldehyde oxime.
    Suvitha A; Periandy S; Boomadevi S; Govindarajan M
    Spectrochim Acta A Mol Biomol Spectrosc; 2014 Jan; 117():216-24. PubMed ID: 23994677
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Vibrational analysis using FT-IR, FT-Raman spectra and HF-DFT methods and NBO, NLO, NMR, HOMO-LUMO, UV and electronic transitions studies on 2,2,4-trimethyl pentane.
    Suvitha A; Periandy S; Govindarajan M; Gayathri P
    Spectrochim Acta A Mol Biomol Spectrosc; 2015 Mar; 138():900-12. PubMed ID: 25459692
    [TBL] [Abstract][Full Text] [Related]  

  • 19. The electronic donation and frequency shifts on the YCCH⋯BH₄⁻ boron-bonded complexes (Y=H, CH₃, CF₃ and CCl₃).
    Pordeus RQ; Rego DG; Oliveira BG
    Spectrochim Acta A Mol Biomol Spectrosc; 2015 Jun; 145():580-587. PubMed ID: 25812944
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Investigations over optical properties of boron complexes of benzothiazolines.
    Tüzün B; Sayin K
    Spectrochim Acta A Mol Biomol Spectrosc; 2019 Feb; 208():48-56. PubMed ID: 30292150
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 6.