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 *

171 related articles for article (PubMed ID: 21425282)

  • 1. Density functional study of structural, electronic, and optical properties of small bimetallic ruthenium-copper clusters.
    Karagiannis EE; Kefalidis CE; Petrakopoulou I; Tsipis CA
    J Comput Chem; 2011 May; 32(7):1241-61. PubMed ID: 21425282
    [TBL] [Abstract][Full Text] [Related]  

  • 2. Structural, electronic, bonding, magnetic, and optical properties of bimetallic [Ru(n)Au(m)](0/+) (n + m ≤ 3) clusters.
    Garbounis DN; Tsipis AC; Tsipis CA
    J Comput Chem; 2010 Dec; 31(16):2836-52. PubMed ID: 20928847
    [TBL] [Abstract][Full Text] [Related]  

  • 3. Electronic, bonding, and optical properties of 1d [CuCN]n (n = 1-10) chains, 2d [CuCN]n (n = 2-10) nanorings, and 3d [Cun (CN)n ]m (n = 4, m = 2, 3; n = 10, m = 2) tubes studied by DFT/TD-DFT methods.
    Tsipis AC; Stalikas AV
    J Comput Chem; 2015 Jun; 36(17):1334-47. PubMed ID: 25907151
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Probing the electronic structure, chemical bonding, and excitation spectra of [CuE](+/0/-) (E = 14 group element) diatomics employing DFT and ab initio methods.
    Tsipis AC; Gkarmpounis DN
    J Comput Chem; 2012 Nov; 33(29):2318-31. PubMed ID: 22825887
    [TBL] [Abstract][Full Text] [Related]  

  • 5. Optical absorption of small copper clusters in neon: Cu(n), (n = 1-9).
    Lecoultre S; Rydlo A; Félix C; Buttet J; Gilb S; Harbich W
    J Chem Phys; 2011 Feb; 134(7):074303. PubMed ID: 21341840
    [TBL] [Abstract][Full Text] [Related]  

  • 6. Geometrical and optical benchmarking of copper guanidine-quinoline complexes: insights from TD-DFT and many-body perturbation theory.
    Jesser A; Rohrmüller M; Schmidt WG; Herres-Pawlis S
    J Comput Chem; 2014 Jan; 35(1):1-17. PubMed ID: 24122864
    [TBL] [Abstract][Full Text] [Related]  

  • 7. Structure and optical properties of core-shell bimetallic Ag(n)Ni(n) clusters: Comparison with pure silver and nickel clusters.
    Harb M; Rabilloud F; Simon D
    J Chem Phys; 2009 Nov; 131(17):174302. PubMed ID: 19895007
    [TBL] [Abstract][Full Text] [Related]  

  • 8. A combined experimental and DFT/TD-DFT investigation of structural, electronic, and cation-induced switching of photophysical properties of bimetallic Ru(II) and Os(II) complexes derived from imidazole-4,5-dicarboxylic acid and 2,2'-bipyridine.
    Das S; Karmakar S; Saha D; Baitalik S
    Inorg Chem; 2013 Jun; 52(12):6860-79. PubMed ID: 23738608
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Vibrational spectra, electronic absorption, nonlinear optical properties, evaluation of bonding, chemical reactivity and thermodynamic properties of ethyl 4-(1-(2-(hydrazinecarbonothioyl)hydrazono)ethyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate molecule by ab initio HF and density functional methods.
    Singh RN; Rawat P; Sahu S
    Spectrochim Acta A Mol Biomol Spectrosc; 2015 Jan; 135():1162-8. PubMed ID: 25168004
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Geometrical and optical benchmarking of copper(II) guanidine-quinoline complexes: insights from TD-DFT and many-body perturbation theory (part II).
    Hoffmann A; Rohrmüller M; Jesser A; dos Santos Vieira I; Schmidt WG; Herres-Pawlis S
    J Comput Chem; 2014 Nov; 35(29):2146-61. PubMed ID: 25255876
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Electronic structures of ruthenium and osmium complexes of 9,10-phenanthrenequinone.
    Biswas MK; Patra SC; Maity AN; Ke SC; Adhikary ND; Ghosh P
    Inorg Chem; 2012 Jun; 51(12):6687-99. PubMed ID: 22663598
    [TBL] [Abstract][Full Text] [Related]  

  • 12. DFT assessment of the spectroscopic constants and absorption spectra of neutral and charged diatomic species of group 11 and 14 elements.
    Tsipis AC
    J Comput Chem; 2014 Sep; 35(24):1762-77. PubMed ID: 25043630
    [TBL] [Abstract][Full Text] [Related]  

  • 13. 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]  

  • 14. DFT Simulation of Structural and Optical Properties of 9-Aminoacridine Half-Sandwich Ru(II), Rh(III), and Ir(III) Antitumoral Complexes and Their Interaction with DNA.
    Cerón-Carrasco JP; Ruiz J; Vicente C; de Haro C; Bautista D; Zúñiga J; Requena A
    J Chem Theory Comput; 2017 Aug; 13(8):3898-3910. PubMed ID: 28641006
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Theoretical study on the electronic excitations of a porphyrin-polypyridyl ruthenium(II) photosensitizer.
    Cárdenas-Jirón GI; Barboza CA; López R; Menéndez MI
    J Phys Chem A; 2011 Nov; 115(43):11988-97. PubMed ID: 21910497
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Valence and spin situations in isomeric [(bpy)Ru(Q')2]n (Q' = 3,5-di-tert-butyl-N-aryl-1,2-benzoquinonemonoimine). An experimental and DFT analysis.
    Das D; Mondal TK; Chowdhury AD; Weisser F; Schweinfurth D; Sarkar B; Mobin SM; Urbanos FA; Jiménez-Aparicio R; Lahiri GK
    Dalton Trans; 2011 Sep; 40(33):8377-90. PubMed ID: 21776528
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Hydrido copper clusters supported by dithiocarbamates: oxidative hydride removal and neutron diffraction analysis of [Cu7(H){S2C(aza-15-crown-5)}6].
    Liao PK; Fang CS; Edwards AJ; Kahlal S; Saillard JY; Liu CW
    Inorg Chem; 2012 Jun; 51(12):6577-91. PubMed ID: 22663192
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Pyrene and imidazole functionalized luminescent bimetallic Ru(II) terpyridine complexes as efficient optical chemosensors for cyanide in aqueous, organic and solid media.
    Karmakar S; Maity D; Mardanya S; Baitalik S
    Dalton Trans; 2015 Nov; 44(42):18607-23. PubMed ID: 26448454
    [TBL] [Abstract][Full Text] [Related]  

  • 19. Unravelling the quenching mechanisms of a luminescent Ru(II) probe for Cu(II).
    Santos AR; Escudero D; González L; Orellana G
    Chem Asian J; 2015 Mar; 10(3):622-9. PubMed ID: 25588909
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Probing the structural evolution of Cu(N) (-), N=9-20, through a comparison of computed electron removal energies and experimental photoelectron spectra.
    Yang M; Yang F; Jackson KA; Jellinek J
    J Chem Phys; 2010 Feb; 132(6):064306. PubMed ID: 20151742
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 9.