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 *

169 related articles for article (PubMed ID: 18666766)

  • 1. Orbital interpretation of kinetic energy density and a direct space comparison of chemical bonding in tetrahedral network solids.
    Seo DK; Weng C
    J Phys Chem A; 2008 Aug; 112(33):7705-16. PubMed ID: 18666766
    [TBL] [Abstract][Full Text] [Related]  

  • 2. The Kohn-Sham kinetic energy density as indicator of the electron localization: atomic shell structure.
    Navarrete-López AM; Garza J; Vargas R
    J Chem Phys; 2008 Mar; 128(10):104110. PubMed ID: 18345880
    [TBL] [Abstract][Full Text] [Related]  

  • 3. Binding entropy and its application to solids.
    Tsirelson VG; Nagy A
    J Phys Chem A; 2009 Aug; 113(31):9022-9. PubMed ID: 19591444
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Topological analysis of electron densities from Kohn-Sham and subsystem density functional theory.
    Kiewisch K; Eickerling G; Reiher M; Neugebauer J
    J Chem Phys; 2008 Jan; 128(4):044114. PubMed ID: 18247937
    [TBL] [Abstract][Full Text] [Related]  

  • 5. Condition on the Kohn-Sham kinetic energy and modern parametrization of the Thomas-Fermi density.
    Lee D; Constantin LA; Perdew JP; Burke K
    J Chem Phys; 2009 Jan; 130(3):034107. PubMed ID: 19173510
    [TBL] [Abstract][Full Text] [Related]  

  • 6. Topology maps of bond descriptors based on the kinetic energy density and the essence of chemical bonding.
    Jacobsen H
    Phys Chem Chem Phys; 2013 Apr; 15(14):5057-66. PubMed ID: 23450168
    [TBL] [Abstract][Full Text] [Related]  

  • 7. Visualization and analysis of the Kohn-Sham kinetic energy density and its orbital-free description in molecules.
    Cancio AC; Stewart D; Kuna A
    J Chem Phys; 2016 Feb; 144(8):084107. PubMed ID: 26931681
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Chemical bonding in view of electron charge density and kinetic energy density descriptors.
    Jacobsen H
    J Comput Chem; 2009 May; 30(7):1093-102. PubMed ID: 19090572
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Role of inner- and outer-sphere bonding in the sensitization of EuIII-luminescence deciphered by combined analysis of experimental electron density distribution function and photophysical data.
    Puntus LN; Lyssenko KA; Antipin MY; Bünzli JC
    Inorg Chem; 2008 Dec; 47(23):11095-107. PubMed ID: 18950154
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Hypovalency--a kinetic-energy density description of a 4c-2e bond.
    Jacobsen H
    Dalton Trans; 2009 Jun; (21):4252-8. PubMed ID: 19452076
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Interesting properties of Thomas-Fermi kinetic and Parr electron-electron-repulsion DFT energy functional generated compact one-electron density approximation for ground-state electronic energy of molecular systems.
    Kristyan S
    J Comput Chem; 2009 Jul; 30(9):1445-53. PubMed ID: 19037858
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Theoretical analysis of the electronic properties of the sex pheromone and its analogue derivatives in the female processionary moth Thaumetopoea pytiocampa.
    Chamorro ER; Sequeira AF; Zalazar MF; Peruchena NM
    Bioorg Med Chem; 2008 Sep; 16(18):8535-45. PubMed ID: 18752964
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Topology of electron charge density for chemical bonds from valence bond theory: a probe of bonding types.
    Zhang L; Ying F; Wu W; Hiberty PC; Shaik S
    Chemistry; 2009; 15(12):2979-89. PubMed ID: 19191241
    [TBL] [Abstract][Full Text] [Related]  

  • 14. Kinetic energy density study of some representative semilocal kinetic energy functionals.
    García-Aldea D; Alvarellos JE
    J Chem Phys; 2007 Oct; 127(14):144109. PubMed ID: 17935388
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Prediction of molecular properties including symmetry from quantum-based molecular structural formulas, VIF.
    Alia JD; Vlaisavljevich B; Abbot M; Warneke H; Mastin T
    J Phys Chem A; 2008 Oct; 112(40):9784-95. PubMed ID: 18800777
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Integration of electron density and molecular orbital techniques to reveal questionable bonds: the test case of the direct Fe-Fe bond in Fe2(CO)9.
    Reinhold J; Kluge O; Mealli C
    Inorg Chem; 2007 Aug; 46(17):7142-7. PubMed ID: 17655289
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Deciphering chemical bonding in golden cages.
    Zubarev DY; Boldyrev AI
    J Phys Chem A; 2009 Feb; 113(5):866-8. PubMed ID: 19175335
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Why does electron sharing lead to covalent bonding? A variational analysis.
    Ruedenberg K; Schmidt MW
    J Comput Chem; 2007 Jan; 28(1):391-410. PubMed ID: 17143869
    [TBL] [Abstract][Full Text] [Related]  

  • 19. How electron localization function quantifies and pictures chemical changes in a solid: the B3-->B1 pressure induced phase transition in BeO.
    Contreras-García J; Pendás AM; Recio JM
    J Phys Chem B; 2008 Aug; 112(32):9787-94. PubMed ID: 18636766
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Developing paradigms of chemical bonding: adaptive natural density partitioning.
    Zubarev DY; Boldyrev AI
    Phys Chem Chem Phys; 2008 Sep; 10(34):5207-17. PubMed ID: 18728862
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 9.