Computer design of tetrapeptide CCK-4 analogues

Pavel E. Kuznetsov; Nina B. Kuznetsova; Sergey V. Schulgin; Svetlana M. Rogacheva; Valeriy V. Sinyakov; Viktor A. Kovtun

doi:10.1117/12.696921

8 August 2006 Computer design of tetrapeptide CCK-4 analogues

Pavel E. Kuznetsov, Nina B. Kuznetsova, Sergey V. Schulgin, Svetlana M. Rogacheva, Valeriy V. Sinyakov, Viktor A. Kovtun

Author Affiliations +

Proceedings Volume 6165, Saratov Fall Meeting 2005: Laser Physics and Photonics, Spectroscopy and Molecular Modeling VI; 61650T (2006) https://doi.org/10.1117/12.696921
Event: Saratov Fall Meeting 2005, 2005, Saratov, Russian Federation

Abstract

In this paper we propose a theoretical method of estimation of biological activity of tetrapeptide cholecystokinin (CCK- 4) analogues according to their structure. The method is based on the prospective mechanism of CCK-4 interaction with CCK-2 receptor. Electron and structural properties of CCK-4 are taken into account. The relationship structure-activity for CCK-4 analogues with the known pharmacological profile have been studied using the model of the ligand-receptor interaction.

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Pavel E. Kuznetsov, Nina B. Kuznetsova, Sergey V. Schulgin, Svetlana M. Rogacheva, Valeriy V. Sinyakov, and Viktor A. Kovtun "Computer design of tetrapeptide CCK-4 analogues", Proc. SPIE 6165, Saratov Fall Meeting 2005: Laser Physics and Photonics, Spectroscopy and Molecular Modeling VI, 61650T (8 August 2006); https://doi.org/10.1117/12.696921

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