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 *

123 related articles for article (PubMed ID: 30144110)

  • 21. A multipolar approach to the interatomic covalent interaction energy.
    Francisco E; Menéndez Crespo D; Costales A; Martín Pendás Á
    J Comput Chem; 2017 Apr; 38(11):816-829. PubMed ID: 28211059
    [TBL] [Abstract][Full Text] [Related]  

  • 22. Partitioning of the molecular density matrix over atoms and bonds.
    Vanfleteren D; Van Neck D; Bultinck P; Ayers PW; Waroquier M
    J Chem Phys; 2010 Apr; 132(16):164111. PubMed ID: 20441262
    [TBL] [Abstract][Full Text] [Related]  

  • 23. On the physical role of exchange in the formation of an intramolecular bond path between two electronegative atoms.
    Tognetti V; Joubert L
    J Chem Phys; 2013 Jan; 138(2):024102. PubMed ID: 23320663
    [TBL] [Abstract][Full Text] [Related]  

  • 24. A reference-free stockholder partitioning method based on the force on electrons.
    Fias S; Heidar-Zadeh F; Anderson JSM; Ayers PW; Parr RG
    J Comput Chem; 2018 Jun; 39(17):1044-1050. PubMed ID: 29151263
    [TBL] [Abstract][Full Text] [Related]  

  • 25. Bond paths between distant atoms do not necessarily indicate dominant interactions.
    Jabłoński M
    J Comput Chem; 2018 Oct; 39(26):2183-2195. PubMed ID: 30298926
    [TBL] [Abstract][Full Text] [Related]  

  • 26. The nature of the hydrogen bond: a synthesis from the interacting quantum atoms picture.
    Martín Pendás A; Blanco MA; Francisco E
    J Chem Phys; 2006 Nov; 125(18):184112. PubMed ID: 17115743
    [TBL] [Abstract][Full Text] [Related]  

  • 27. Performance of the density matrix functional theory in the quantum theory of atoms in molecules.
    García-Revilla M; Francisco E; Costales A; Martín Pendás A
    J Phys Chem A; 2012 Feb; 116(4):1237-50. PubMed ID: 21943031
    [TBL] [Abstract][Full Text] [Related]  

  • 28. The Ehrenfest force topology: a physically intuitive approach for analyzing chemical interactions.
    Maza JR; Jenkins S; Kirk SR; Anderson JS; Ayers PW
    Phys Chem Chem Phys; 2013 Nov; 15(41):17823-36. PubMed ID: 24045853
    [TBL] [Abstract][Full Text] [Related]  

  • 29. On the Unusual Synclinal Conformations of Hexafluorobutadiene and Structurally Similar Molecules.
    Braden DA; Matta CF
    J Phys Chem A; 2018 May; 122(18):4538-4548. PubMed ID: 29694045
    [TBL] [Abstract][Full Text] [Related]  

  • 30. Atom-atom partitioning of total (super)molecular energy: the hidden terms of classical force fields.
    Rafat M; Popelier PL
    J Comput Chem; 2007 Jan; 28(1):292-301. PubMed ID: 17109431
    [TBL] [Abstract][Full Text] [Related]  

  • 31. Characterizing the oxygen-oxygen interaction in the dinitramide anion.
    Zhurova EA; Tsirelson VG; Stash AI; Pinkerton AA
    J Am Chem Soc; 2002 May; 124(17):4574-5. PubMed ID: 11971700
    [TBL] [Abstract][Full Text] [Related]  

  • 32. Electron density distributions calculated for the nickel sulfides millerite, vaesite, and heazlewoodite and nickel metal: a case for the importance of ni-ni bond paths for electron transport.
    Gibbs GV; Downs RT; Prewitt CT; Rosso KM; Ross NL; Cox DF
    J Phys Chem B; 2005 Nov; 109(46):21788-95. PubMed ID: 16853830
    [TBL] [Abstract][Full Text] [Related]  

  • 33. Atomic charges, dipole moments, and Fukui functions using the Hirshfeld partitioning of the electron density.
    De Proft F; Van Alsenoy C; Peeters A; Langenaeker W; Geerlings P
    J Comput Chem; 2002 Sep; 23(12):1198-209. PubMed ID: 12116389
    [TBL] [Abstract][Full Text] [Related]  

  • 34. Energetic and geometrical evidence of nonbonding character of some intramolecular halogen···oxygen and other Y···Y interactions.
    Jabłoński M
    J Phys Chem A; 2012 Apr; 116(14):3753-64. PubMed ID: 22432471
    [TBL] [Abstract][Full Text] [Related]  

  • 35. Atom and Bond Fukui Functions and Matrices: A Hirshfeld-I Atoms-in-Molecule Approach.
    Oña OB; De Clercq O; Alcoba DR; Torre A; Lain L; Van Neck D; Bultinck P
    Chemphyschem; 2016 Sep; 17(18):2881-9. PubMed ID: 27381271
    [TBL] [Abstract][Full Text] [Related]  

  • 36. Partitioning a Molecule into the Atomic Basins and the Resultant Atomic Charges from Quantum Chemical Topology Analysis of the Kohn-Sham Potential.
    Zhao DX; Zhao J; Yang ZZ
    J Phys Chem A; 2020 Jun; 124(24):5023-5032. PubMed ID: 32423212
    [TBL] [Abstract][Full Text] [Related]  

  • 37. Toward a consistent interpretation of the QTAIM: tortuous link between chemical bonds, interactions, and bond/line paths.
    Foroutan-Nejad C; Shahbazian S; Marek R
    Chemistry; 2014 Aug; 20(32):10140-52. PubMed ID: 24990224
    [TBL] [Abstract][Full Text] [Related]  

  • 38. Characterization of a closed-shell fluorine-fluorine bonding interaction in aromatic compounds on the basis of the electron density.
    Matta CF; Castillo N; Boyd RJ
    J Phys Chem A; 2005 Apr; 109(16):3669-81. PubMed ID: 16839033
    [TBL] [Abstract][Full Text] [Related]  

  • 39. Bond paths as privileged exchange channels.
    Pendás AM; Francisco E; Blanco MA; Gatti C
    Chemistry; 2007; 13(33):9362-71. PubMed ID: 17674344
    [TBL] [Abstract][Full Text] [Related]  

  • 40. Atoms in molecules in real space: a fertile field for chemical bonding.
    Martín Pendás Á; Francisco E; Suárez D; Costales A; Díaz N; Munárriz J; Rocha-Rinza T; Guevara-Vela JM
    Phys Chem Chem Phys; 2023 Apr; 25(15):10231-10262. PubMed ID: 36994471
    [TBL] [Abstract][Full Text] [Related]  

    [Previous]   [Next]    [New Search]
    of 7.