Квантовохімічне дослідження особливостей взаємодії різних типів вуглецевих нанотрубок з амінокислотами

Interaction between carbon nanotubes (CNT) (n, 0) and (n, n) with amino acids has been investigation by semiempirical quantum-chemical method PM3. An equilibrium structures of the CNT (8.0) and (6.6) surface and ports with molecules of cysteine​​, homocysteine, methionine, cystine and valine were fo...

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Bibliographic Details
Date:2012
Main Author: Datsyuk, A. M.
Format: Article
Language:Ukrainian
Published: Chuiko Institute of Surface Chemistry National Academy of Sciences of Ukraine 2012
Online Access:https://surfacezbir.com.ua/index.php/surface/article/view/473
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Journal Title:Surface
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Surface
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Summary:Interaction between carbon nanotubes (CNT) (n, 0) and (n, n) with amino acids has been investigation by semiempirical quantum-chemical method PM3. An equilibrium structures of the CNT (8.0) and (6.6) surface and ports with molecules of cysteine​​, homocysteine, methionine, cystine and valine were found. It were shown that the nanotube surface sufficiently inert to interaction as with common amino acids (for example, valine) and sulfuric aminoacids. The interaction of the considered biomolecules strongly turns with ports CNT of (8.0) and weaker with (6.6) CNT.