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JOURNALS // Vestnik Samarskogo Universiteta. Estestvenno-Nauchnaya Seriya // Archive

Vestnik Samarskogo Gosudarstvennogo Universiteta. Estestvenno-Nauchnaya Seriya, 2012 Issue 3/1(94), Pages 156–163 (Mi vsgu15)

Chemistry

The estimation of hydrophobicity and the analysis of hydrogen bonds in the most persistent conformers of molecules of synthesized adamantyl-containing tripeptides

S. V. Obukhov, P. P. Purygin, E. A. Stepanov, Yu. P. Zarubin

Dept. of Organic, Bioorganic and Medicinal Chemistry, Samara State University, Samara, 443011, Russian Federation

Abstract: Adamantyl-containing tripeptides with potential antiviral activity are synthesized. Applying methods of computational chemistry hydrophobic properties were estimated. Search of the most persistent conformers was made and the analysis of intramolecular hydrogen bonds to these peptides was performed.

Keywords: peptides, derivatives, adamantyl, antiviral activity, computational calculation, hydrophobic properties, conformers, most persistent, hydrogen bonds, intramolecular.

UDC: 577.338+577.123.36

Received: 16.03.2012
Revised: 16.03.2012



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