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Conformational Analysis of Cyclo(Tyr-Cys) and Cyclo(Phe-Cys) Dipeptides

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dc.creator CELIK, Sefa
dc.creator KECEL GUNDUZ, Serda
dc.date 2017-05-11T00:00:00Z
dc.date.accessioned 2019-07-09T12:00:15Z
dc.date.available 2019-07-09T12:00:15Z
dc.identifier http://dergipark.org.tr/sdufenbed/issue/34634/382551
dc.identifier 10.19113/sdufbed.12478
dc.identifier.uri http://acikerisim.sdu.edu.tr/xmlui/handle/123456789/46663
dc.description In this study, eight possible stable conformers of the Cyclo(Tyr-Cys) and Cyclo(Phe-Cys) dipeptides, which show the most significant inhibition in cervical carcinoma cells opposite to HT-29 and MCF-7 cells, performed depending on the obtained conformational analysis. The possible stable geometries were determined with the aid of φ, Ψ backbone and c chain dihedral angles. Available all conformers and their energies were calculated and made comparison with the quantum chemical ab-initio results. The Van der Waals, electrostatic , torsional , interaction energies between side and main chains of aminoacids and total energies of cysteine containing dipeptides were computed by using Fortran program.
dc.format application/pdf
dc.publisher Süleyman Demirel University
dc.publisher Süleyman Demirel Üniversitesi
dc.relation http://dergipark.org.tr/download/article-file/409366
dc.source Volume: 21, Issue: 2 306-310 en-US
dc.source 1308-6529
dc.subject Cyclic dipeptides,Conformational analysis; DFT
dc.title Conformational Analysis of Cyclo(Tyr-Cys) and Cyclo(Phe-Cys) Dipeptides en-US
dc.type info:eu-repo/semantics/article


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