Literature DB >> 17411107

The electrostatic surface term: (I) periodic systems.

Henry David Herce1, Angel Enrique Garcia, Thomas Darden.   

Abstract

The authors propose a new approach to understand the electrostatic surface contributions to the interactions of large but finite periodic distributions of charges. They present a simple method to derive and interpret the surface contribution to any electrostatic field produced by a periodic distribution of charges. They discuss the physical and mathematical interpretations of this term. They present several examples and physical details associated with the calculation of the surface term. Finally, they provide a simple derivation of the surface contribution to the virial. This term does not disappear even if tinfoil boundary conditions are applied.

Mesh:

Year:  2007        PMID: 17411107     DOI: 10.1063/1.2714527

Source DB:  PubMed          Journal:  J Chem Phys        ISSN: 0021-9606            Impact factor:   3.488


  7 in total

1.  Protonation of Glu(135) Facilitates the Outward-to-Inward Structural Transition of Fucose Transporter.

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Journal:  Biophys J       Date:  2015-08-04       Impact factor: 4.033

2.  Molecular dynamics simulations suggest a mechanism for translocation of the HIV-1 TAT peptide across lipid membranes.

Authors:  Henry D Herce; Angel E Garcia
Journal:  Proc Natl Acad Sci U S A       Date:  2007-12-18       Impact factor: 11.205

3.  Cell penetrating peptides: how do they do it?

Authors:  Henry D Herce; Angel E Garcia
Journal:  J Biol Phys       Date:  2008-05-15       Impact factor: 1.365

4.  The Effects of Calcium on Lipid-Protein Interactions and Ion Flux in the Cx26 Connexon Embedded into a POPC Bilayer.

Authors:  Juan M R Albano; Gabriel E Jara; M Laura Fernández; Julio C Facelli; Marta B Ferraro; Monica Pickholz
Journal:  J Membr Biol       Date:  2019-08-22       Impact factor: 1.843

5.  Calcium interactions with Cx26 hemmichannel: Spatial association between MD simulations biding sites and variant pathogenicity.

Authors:  Juan M R Albano; Nahuel Mussini; Roxana Toriano; Julio C Facelli; Marta B Ferraro; Mónica Pickholz
Journal:  Comput Biol Chem       Date:  2018-11-12       Impact factor: 2.877

6.  Alternative mechanisms for the interaction of the cell-penetrating peptides penetratin and the TAT peptide with lipid bilayers.

Authors:  Semen Yesylevskyy; Siewert-Jan Marrink; Alan E Mark
Journal:  Biophys J       Date:  2009-07-08       Impact factor: 4.033

Review 7.  The carboxylation status of osteocalcin has important consequences for its structure and dynamics.

Authors:  Karan Kapoor; Min Pi; Satoru Kenneth Nishimoto; Leigh Darryl Quarles; Jerome Baudry; Jeremy C Smith
Journal:  Biochim Biophys Acta Gen Subj       Date:  2020-12-17       Impact factor: 3.770

  7 in total

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