A method to determine and classify the chirality of the water medium
- Autores: Khakhalin A.V.1, Gradoboeva O.N.1
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Afiliações:
- Lomonosov Moscow State University
- Edição: Volume 57, Nº 5 (2016)
- Páginas: 934-939
- Seção: Article
- URL: https://journals.rcsi.science/0022-4766/article/view/160185
- DOI: https://doi.org/10.1134/S0022476616050127
- ID: 160185
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Resumo
A new numerical method to determine the chirality of water configurations is developed. It consists in the comparison of matrices composed for both initial configuration and its mirror image based on the information of four bound water molecules. The method developed enables the rapid and unambiguous determination of the chirality of an aqueous system.
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Sobre autores
A. Khakhalin
Lomonosov Moscow State University
Autor responsável pela correspondência
Email: avkhakhalin@mail.ru
Rússia, Moscow
O. Gradoboeva
Lomonosov Moscow State University
Email: avkhakhalin@mail.ru
Rússia, Moscow
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