Molecular modeling of vermiculite chlorhexidine diacetate nanocomposite

Result code in IS VaVaI

<a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F61989100%3A27640%2F12%3A86083989" target="_blank" >RIV/61989100:27640/12:86083989 - isvavai.cz</a>

Result on the web

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DOI - Digital Object Identifier

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Result language

angličtina

Original language name

Molecular modeling of vermiculite chlorhexidine diacetate nanocomposite

Original language description

The aim of this work is to give closer information about iterlayer structure of vermiculite-chlorhexidine diacetate nanocomposite. Molecular modeling using empirical force field was performed in this study and obtained results were confronted with available experimental data of the real samples. Obtained results indicate that only certain limited amount of chlorhexidine cations can be introduced into the vermiculite interlayer space. This suggests that it is the vermiculite surface which is primarily responsible for the modulation of antibacterial properties of vermiculite-chlorhexidine diacetate nanocomposite.

Czech name

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Czech description

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Type

J_x - Unclassified - Peer-reviewed scientific article (Jimp, Jsc and Jost)

CEP classification

JI - Composite materials

OECD FORD branch

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Project

<a href="/en/project/ED1.1.00%2F02.0070" target="_blank" >ED1.1.00/02.0070: IT4Innovations Centre of Excellence</a><br>

Continuities

P - Projekt vyzkumu a vyvoje financovany z verejnych zdroju (s odkazem do CEP)

Publication year

2012

Confidentiality

S - Úplné a pravdivé údaje o projektu nepodléhají ochraně podle zvláštních právních předpisů

Name of the periodical

Journal of Nanocomposites and Nanoceramics

ISSN

0976-6294

e-ISSN

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Volume of the periodical

3

Issue of the periodical within the volume

1

Country of publishing house

IN - INDIA

Number of pages

5

Pages from-to

15-19

UT code for WoS article

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EID of the result in the Scopus database

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