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 *

98 related articles for article (PubMed ID: 24784241)

  • 1. Communication: on the origin of the surface term in the Ewald formula.
    Ballenegger V
    J Chem Phys; 2014 Apr; 140(16):161102. PubMed ID: 24784241
    [TBL] [Abstract][Full Text] [Related]  

  • 2. Simple and accurate scheme to compute electrostatic interaction: zero-dipole summation technique for molecular system and application to bulk water.
    Fukuda I; Kamiya N; Yonezawa Y; Nakamura H
    J Chem Phys; 2012 Aug; 137(5):054314. PubMed ID: 22894355
    [TBL] [Abstract][Full Text] [Related]  

  • 3. Simulations of Coulomb systems with slab geometry using an efficient 3D Ewald summation method.
    dos Santos AP; Girotto M; Levin Y
    J Chem Phys; 2016 Apr; 144(14):144103. PubMed ID: 27083704
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Infinite Boundary Terms of Ewald Sums and Pairwise Interactions for Electrostatics in Bulk and at Interfaces.
    Hu Z
    J Chem Theory Comput; 2014 Dec; 10(12):5254-64. PubMed ID: 26583209
    [TBL] [Abstract][Full Text] [Related]  

  • 5. A formula and numerical study on Ewald 1D summation.
    Pan C
    J Comput Chem; 2023 Mar; 44(8):902-911. PubMed ID: 36479716
    [TBL] [Abstract][Full Text] [Related]  

  • 6. Software for Evaluating Long-Range Electrostatic Interactions Based on the Ewald Summation and Its Application to Electrochemical Energy Storage Materials.
    Shi W; He B; Pu B; Ren Y; Avdeev M; Shi S
    J Phys Chem A; 2022 Aug; 126(31):5222-5230. PubMed ID: 35900935
    [TBL] [Abstract][Full Text] [Related]  

  • 7. Damped reaction field method and the accelerated convergence of the real space Ewald summation.
    Elvira VH; MacDowell LG
    J Chem Phys; 2014 Oct; 141(16):164108. PubMed ID: 25362273
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Some comments and corrections regarding the calculation of electrostatic potential derivatives using the Ewald summation technique.
    Stenhammar J; Trulsson M; Linse P
    J Chem Phys; 2011 Jun; 134(22):224104. PubMed ID: 21682504
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Fast and spectrally accurate Ewald summation for 2-periodic electrostatic systems.
    Lindbo D; Tornberg AK
    J Chem Phys; 2012 Apr; 136(16):164111. PubMed ID: 22559474
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Rigorous Error Bounds for Ewald Summation of Electrostatics at Planar Interfaces.
    Pan C; Hu Z
    J Chem Theory Comput; 2014 Feb; 10(2):534-42. PubMed ID: 26580030
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Cutoff radius effect of the isotropic periodic sum and Wolf method in liquid-vapor interfaces of water.
    Takahashi KZ; Narumi T; Yasuoka K
    J Chem Phys; 2011 May; 134(17):174112. PubMed ID: 21548678
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Atomic charges derived from electrostatic potentials for molecular and periodic systems.
    Chen DL; Stern AC; Space B; Johnson JK
    J Phys Chem A; 2010 Sep; 114(37):10225-33. PubMed ID: 20795694
    [TBL] [Abstract][Full Text] [Related]  

  • 13. A coherent derivation of the Ewald summation for arbitrary orders of multipoles: The self-terms.
    Stamm B; Lagardère L; Polack É; Maday Y; Piquemal JP
    J Chem Phys; 2018 Sep; 149(12):124103. PubMed ID: 30278683
    [TBL] [Abstract][Full Text] [Related]  

  • 14. The u-series: A separable decomposition for electrostatics computation with improved accuracy.
    Predescu C; Lerer AK; Lippert RA; Towles B; Grossman JP; Dirks RM; Shaw DE
    J Chem Phys; 2020 Feb; 152(8):084113. PubMed ID: 32113352
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Notes on "Ewald summation of electrostatic multipole interactions up to quadrupolar level" [J. Chem. Phys. 119, 7471 (2003)].
    Laino T; Hutter J
    J Chem Phys; 2008 Aug; 129(7):074102. PubMed ID: 19044755
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Three-dimensional Ewald method with correction term for a system periodic in one direction.
    Bródka A; Sliwiński P
    J Chem Phys; 2004 Mar; 120(12):5518-23. PubMed ID: 15267427
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Ewald Summation for Uniformly Charged Surface.
    Yang W; Jin X; Liao Q
    J Chem Theory Comput; 2006 Nov; 2(6):1618-23. PubMed ID: 26627032
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Simulations of non-neutral slab systems with long-range electrostatic interactions in two-dimensional periodic boundary conditions.
    Ballenegger V; Arnold A; Cerdà JJ
    J Chem Phys; 2009 Sep; 131(9):094107. PubMed ID: 19739849
    [TBL] [Abstract][Full Text] [Related]  

  • 19. Examining methods for calculations of binding free energies: LRA, LIE, PDLD-LRA, and PDLD/S-LRA calculations of ligands binding to an HIV protease.
    Sham YY; Chu ZT; Tao H; Warshel A
    Proteins; 2000 Jun; 39(4):393-407. PubMed ID: 10813821
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Is the Ewald summation still necessary? Pairwise alternatives to the accepted standard for long-range electrostatics.
    Fennell CJ; Gezelter JD
    J Chem Phys; 2006 Jun; 124(23):234104. PubMed ID: 16821904
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 5.