Wordt geladen...

Introducing Titratable Water to All-Atom Molecular Dynamics at Constant pH

Recent development of titratable coions has paved the way for realizing all-atom molecular dynamics at constant pH. To further improve physical realism, here we describe a technique in which proton titration of the solute is directly coupled to the interconversion between water and hydroxide or hydr...

Volledige beschrijving

Bewaard in:
Bibliografische gegevens
Hoofdauteurs: Chen, Wei, Wallace, Jason A., Yue, Zhi, Shen, Jana K.
Formaat: Artigo
Taal:Inglês
Gepubliceerd in: The Biophysical Society 2013
Onderwerpen:
Online toegang:https://ncbi.nlm.nih.gov/pmc/articles/PMC3752133/
https://ncbi.nlm.nih.gov/pubmed/23972860
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1016/j.bpj.2013.06.036
Tags: Voeg label toe
Geen labels, Wees de eerste die dit record labelt!