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 *

268 related articles for article (PubMed ID: 19173505)

  • 21. Theoretical study on the circular dichroism in core and valence photoelectron angular distributions of camphor enantiomers.
    Stener M; Di Tommaso D; Fronzoni G; Decleva P; Powis I
    J Chem Phys; 2006 Jan; 124(2):024326. PubMed ID: 16422602
    [TBL] [Abstract][Full Text] [Related]  

  • 22. Electron correlation as the driving force for charge transfer: charge migration following ionization in N-methyl acetamide.
    Hennig H; Breidbach J; Cederbaum LS
    J Phys Chem A; 2005 Jan; 109(3):409-14. PubMed ID: 16833360
    [TBL] [Abstract][Full Text] [Related]  

  • 23. Theoretical study on the sound absorption of electrolytic solutions. II. Assignments of relaxations.
    Yamaguchi T; Matsuoka T; Koda S
    J Chem Phys; 2007 Aug; 127(6):064508. PubMed ID: 17705613
    [TBL] [Abstract][Full Text] [Related]  

  • 24. A state-specific polarizable continuum model time dependent density functional theory method for excited state calculations in solution.
    Improta R; Barone V; Scalmani G; Frisch MJ
    J Chem Phys; 2006 Aug; 125(5):054103. PubMed ID: 16942199
    [TBL] [Abstract][Full Text] [Related]  

  • 25. Exciton analysis in 2D electronic spectroscopy.
    Cho M; Vaswani HM; Brixner T; Stenger J; Fleming GR
    J Phys Chem B; 2005 Jun; 109(21):10542-56. PubMed ID: 16852278
    [TBL] [Abstract][Full Text] [Related]  

  • 26. Comparison of overlap-based models for approximating the exchange-repulsion energy.
    Söderhjelm P; Karlström G; Ryde U
    J Chem Phys; 2006 Jun; 124(24):244101. PubMed ID: 16821967
    [TBL] [Abstract][Full Text] [Related]  

  • 27. Ab initio study of ionic liquids by KS-DFT/3D-RISM-KH theory.
    Malvaldi M; Bruzzone S; Chiappe C; Gusarov S; Kovalenko A
    J Phys Chem B; 2009 Mar; 113(11):3536-42. PubMed ID: 19278268
    [TBL] [Abstract][Full Text] [Related]  

  • 28. Quasicontinuum-like reduction of density functional theory calculations of nanostructures.
    Negrut D; Anitescu M; El-Azab A; Zapol P
    J Nanosci Nanotechnol; 2008 Jul; 8(7):3729-40. PubMed ID: 19051930
    [TBL] [Abstract][Full Text] [Related]  

  • 29. First principles local pseudopotential for silver: towards orbital-free density-functional theory for transition metals.
    Zhou B; Carter EA
    J Chem Phys; 2005 May; 122(18):184108. PubMed ID: 15918695
    [TBL] [Abstract][Full Text] [Related]  

  • 30. Calculation of nonadiabatic couplings with restricted open-shell Kohn-Sham density-functional theory.
    Billeter SR; Egli D
    J Chem Phys; 2006 Dec; 125(22):224103. PubMed ID: 17176130
    [TBL] [Abstract][Full Text] [Related]  

  • 31. Ca, Cd, Zn, and their ions interacting with Cytosine: a theoretical study.
    Vazquez MV; Martínez A
    J Phys Chem A; 2007 Oct; 111(39):9931-9. PubMed ID: 17850047
    [TBL] [Abstract][Full Text] [Related]  

  • 32. Differential virial theorem in relation to a sum rule for the exchange-correlation force in density-functional theory.
    Holas A; March NH; Rubio A
    J Chem Phys; 2005 Nov; 123(19):194104. PubMed ID: 16321073
    [TBL] [Abstract][Full Text] [Related]  

  • 33. Quantum-classical Liouville dynamics in the mapping basis.
    Kim H; Nassimi A; Kapral R
    J Chem Phys; 2008 Aug; 129(8):084102. PubMed ID: 19044813
    [TBL] [Abstract][Full Text] [Related]  

  • 34. Exact Kohn-Sham potential of strongly correlated finite systems.
    Helbig N; Tokatly IV; Rubio A
    J Chem Phys; 2009 Dec; 131(22):224105. PubMed ID: 20001022
    [TBL] [Abstract][Full Text] [Related]  

  • 35. Electronic structure of the water dimer cation.
    Pieniazek PA; VandeVondele J; Jungwirth P; Krylov AI; Bradforth SE
    J Phys Chem A; 2008 Jul; 112(27):6159-70. PubMed ID: 18563882
    [TBL] [Abstract][Full Text] [Related]  

  • 36. Migration of holes: numerical algorithms and implementation.
    Breidbach J; Cederbaum LS
    J Chem Phys; 2007 Jan; 126(3):034101. PubMed ID: 17249859
    [TBL] [Abstract][Full Text] [Related]  

  • 37. Assessment of a simple correction for the long-range charge-transfer problem in time-dependent density-functional theory.
    Neugebauer J; Gritsenko O; Baerends EJ
    J Chem Phys; 2006 Jun; 124(21):214102. PubMed ID: 16774393
    [TBL] [Abstract][Full Text] [Related]  

  • 38. Localized Hartree product treatment of multiple protons in the nuclear-electronic orbital framework.
    Auer B; Hammes-Schiffer S
    J Chem Phys; 2010 Feb; 132(8):084110. PubMed ID: 20192293
    [TBL] [Abstract][Full Text] [Related]  

  • 39. Illustration of transition path theory on a collection of simple examples.
    Metzner P; Schütte C; Vanden-Eijnden E
    J Chem Phys; 2006 Aug; 125(8):084110. PubMed ID: 16965004
    [TBL] [Abstract][Full Text] [Related]  

  • 40. Charge localization in stacked radical cation DNA base pairs and the benzene dimer studied by self-interaction corrected density-functional theory.
    Mantz YA; Gervasio FL; Laino T; Parrinello M
    J Phys Chem A; 2007 Jan; 111(1):105-12. PubMed ID: 17201393
    [TBL] [Abstract][Full Text] [Related]  

    [Previous]   [Next]    [New Search]
    of 14.