Interactions between cyclic nucleotides and common cations: an ab initio molecular dynamics study.

Cations / chemistry Molecular Dynamics Simulation Nucleotides, Cyclic / chemistry Water / chemistry

Journal

Physical chemistry chemical physics : PCCP
ISSN: 1463-9084
Titre abrégé: Phys Chem Chem Phys
Pays: England
ID NLM: 100888160

Informations de publication

Date de publication:
21 Apr 2019
Historique:
pubmed: 2 4 2019
medline: 13 4 2019
entrez: 2 4 2019
Statut: ppublish

Résumé

We present the first, to the best of our knowledge, ab initio molecular dynamics (AIMD) investigation on three aqueous solutions where an abasic cyclic nucleotide model is solvated in the presence of distinct cations (i.e., Na

Identifiants

DOI: 10.1039/c8cp07492e PMID: 30932112
pubmed: 30932112
doi: 10.1039/c8cp07492e
doi:

Substances chimiques

Cations 0
Nucleotides, Cyclic 0
Water 059QF0KO0R

Types de publication

Journal Article

Langues

eng

Sous-ensembles de citation

IM

Pagination

8121-8132

Auteurs

Giuseppe Cassone (G)

Institute of Biophysics of the Czech Academy of Sciences, v.v.i, Královopolská 135, 61265 Brno, Czech Republic. cassone@ibp.cz kruse@ibp.cz.

Holger Kruse (H)

Jiri Sponer (J)

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Classifications MeSH

questionsmedicales.fr › Produits chimiques inorganiques › Électrolytes › Ions › Cations › Interactions between cyclic nucleotides and...
questionsmedicales.fr › Sciences de l'information › Méthodologies informatiques › Simulation numérique › Simulation de dynamique moléculaire › Interactions between cyclic nucleotides and...
questionsmedicales.fr › Acides nucléiques, nucléotides et nucléosides › Nucléotides › Nucléotides cycliques › Interactions between cyclic nucleotides and...
questionsmedicales.fr › Produits chimiques inorganiques › Composés de l'oxygène › Oxydes › Eau › Interactions between cyclic nucleotides and...