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 *

175 related articles for article (PubMed ID: 30795654)

  • 1. Efficient simulation of near-edge x-ray absorption fine structure (NEXAFS) in density-functional theory: Comparison of core-level constraining approaches.
    Michelitsch GS; Reuter K
    J Chem Phys; 2019 Feb; 150(7):074104. PubMed ID: 30795654
    [TBL] [Abstract][Full Text] [Related]  

  • 2. Towards Understanding Excited-State Properties of Organic Molecules Using Time-Resolved Soft X-ray Absorption Spectroscopy.
    Stiel H; Braenzel J; Jonas A; Gnewkow R; Glöggler LT; Sommer D; Krist T; Erko A; Tümmler J; Mantouvalou I
    Int J Mol Sci; 2021 Dec; 22(24):. PubMed ID: 34948258
    [TBL] [Abstract][Full Text] [Related]  

  • 3. An efficient first principles method for molecular pump-probe NEXAFS spectra: Application to thymine and azobenzene.
    Ehlert C; Gühr M; Saalfrank P
    J Chem Phys; 2018 Oct; 149(14):144112. PubMed ID: 30316280
    [TBL] [Abstract][Full Text] [Related]  

  • 4. PSIXAS: A Psi4 plugin for efficient simulations of X-ray absorption spectra based on the transition-potential and Δ-Kohn-Sham method.
    Ehlert C; Klamroth T
    J Comput Chem; 2020 Jul; 41(19):1781-1789. PubMed ID: 32394459
    [TBL] [Abstract][Full Text] [Related]  

  • 5. Hydrogen bonding in acetone clusters probed by near-edge x-ray absorption fine structure spectroscopy in the carbon and oxygen K-edge regions.
    Tamenori Y; Takahashi O; Yamashita K; Yamaguchi T; Okada K; Tabayashi K; Gejo T; Honma K
    J Chem Phys; 2009 Nov; 131(17):174311. PubMed ID: 19895016
    [TBL] [Abstract][Full Text] [Related]  

  • 6. Time-dependent density functional theory calculations of near-edge X-ray absorption fine structure with short-range corrected functionals.
    Besley NA; Peach MJ; Tozer DJ
    Phys Chem Chem Phys; 2009 Nov; 11(44):10350-8. PubMed ID: 19890519
    [TBL] [Abstract][Full Text] [Related]  

  • 7. A detailed assignment of NEXAFS resonances of imidazolium based ionic liquids.
    Ehlert C; Holzweber M; Lippitz A; Unger WE; Saalfrank P
    Phys Chem Chem Phys; 2016 Mar; 18(12):8654-61. PubMed ID: 26948544
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Sulfur 1s near-edge x-ray absorption fine structure (NEXAFS) of thiol and thioether compounds.
    Beyhan S; Hu Y; Urquhart SG
    J Chem Phys; 2011 Jun; 134(24):244304. PubMed ID: 21721627
    [TBL] [Abstract][Full Text] [Related]  

  • 9. The nuts and bolts of core-hole constrained
    Klein BP; Hall SJ; Maurer RJ
    J Phys Condens Matter; 2021 Feb; 33(15):. PubMed ID: 33682682
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Bonding and charge transfer in nitrogen-donor uranyl complexes: insights from NEXAFS spectra.
    Pemmaraju CD; Copping R; Wang S; Janousch M; Teat SJ; Tyliszcak T; Canning A; Shuh DK; Prendergast D
    Inorg Chem; 2014 Nov; 53(21):11415-25. PubMed ID: 25330350
    [TBL] [Abstract][Full Text] [Related]  

  • 11. High resolution NEXAFS of perylene and PTCDI: a surface science approach to molecular orbital analysis.
    Fratesi G; Lanzilotto V; Stranges S; Alagia M; Brivio GP; Floreano L
    Phys Chem Chem Phys; 2014 Jul; 16(28):14834-44. PubMed ID: 24924641
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Matrix effects in the carbon 1s near edge x-ray absorption fine structure spectra of condensed alkanes.
    Urquhart SG; Gillies R
    J Chem Phys; 2006 Jun; 124(23):234704. PubMed ID: 16821938
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Sulfur 1s near edge x-ray absorption fine structure spectroscopy of thiophenic and aromatic thioether compounds.
    Behyan S; Hu Y; Urquhart SG
    J Chem Phys; 2013 Jun; 138(21):214302. PubMed ID: 23758366
    [TBL] [Abstract][Full Text] [Related]  

  • 14. Predictions of Pre-edge Features in Time-Resolved Near-Edge X-ray Absorption Fine Structure Spectroscopy from Hole-Hole Tamm-Dancoff-Approximated Density Functional Theory.
    Hohenstein EG; Yu JK; Bannwarth C; List NH; Paul AC; Folkestad SD; Koch H; Martínez TJ
    J Chem Theory Comput; 2021 Nov; 17(11):7120-7133. PubMed ID: 34623139
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Incisive probing of intermolecular interactions in molecular crystals: core level spectroscopy combined with density functional theory.
    Stevens JS; Seabourne CR; Jaye C; Fischer DA; Scott AJ; Schroeder SL
    J Phys Chem B; 2014 Oct; 118(42):12121-9. PubMed ID: 25248405
    [TBL] [Abstract][Full Text] [Related]  

  • 16. On the Electronic Structure of Cu Chlorophyllin and Its Breakdown Products: A Carbon K-Edge X-ray Absorption Spectroscopy Study.
    Witte K; Mantouvalou I; Sánchez-de-Armas R; Lokstein H; Lebendig-Kuhla J; Jonas A; Roth F; Kanngießer B; Stiel H
    J Phys Chem B; 2018 Feb; 122(6):1846-1851. PubMed ID: 29350531
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Carbon and Nitrogen K-Edge NEXAFS Spectra of Indole, 2,3-Dihydro-7-azaindole, and 3-Formylindole.
    Ponzi A; Bernes E; Toffoli D; Fronzoni G; Callegari C; Ciavardini A; Di Fraia M; Richter R; Prince KC; Sa'adeh H; Devetta M; Faccialà D; Vozzi C; Avaldi L; Bolognesi P; Castrovilli MC; Catone D; Coreno M; Plekan O
    J Phys Chem A; 2021 May; 125(19):4160-4172. PubMed ID: 33961434
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Electronic structure of individual hybrid colloid particles studied by near-edge X-ray absorption fine structure (NEXAFS) spectroscopy in the X-ray microscope.
    Henzler K; Guttmann P; Lu Y; Polzer F; Schneider G; Ballauff M
    Nano Lett; 2013 Feb; 13(2):824-8. PubMed ID: 23360082
    [TBL] [Abstract][Full Text] [Related]  

  • 19. Dopamine adsorption on anatase TiO2(101): a photoemission and NEXAFS spectroscopy study.
    Syres K; Thomas A; Bondino F; Malvestuto M; Grätzel M
    Langmuir; 2010 Sep; 26(18):14548-55. PubMed ID: 20735026
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Photoemission and photoabsorption spectroscopy of glycyl-glycine in the gas phase.
    Feyer V; Plekan O; Richter R; Coreno M; Prince KC; Carravetta V
    J Phys Chem A; 2009 Oct; 113(40):10726-33. PubMed ID: 19757775
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 9.