Tiyosemikarbazon ve metal komplekslerinin yapı aktivite ilişkisinin elektron topoloji yöntemiyle incelenmesi
| dc.contributor.advisor | Kandemirli, Fatma | |
| dc.contributor.author | Çavuşoğlu, İlknur | |
| dc.date.accessioned | 2020-12-29T13:09:39Z | |
| dc.date.available | 2020-12-29T13:09:39Z | |
| dc.date.submitted | 2004 | |
| dc.date.issued | 2018-08-06 | |
| dc.identifier.uri | https://acikbilim.yok.gov.tr/handle/20.500.12812/420405 | |
| dc.description.abstract | TİYOSEMİKARBAZON ve METAL KOMPLEKSLERİNİN YAPI AKTİVİTE İLİŞKİSİNİN ELEKTRON TOPOLOJİ YÖNTEMİYLE İNCELENMESİ İlknur ÇAVUŞOĞLU Anahtar KelimelenElektron-Topoloji Metot, Tripanosidal tiyosemikarbazon inhibitörler, Yapı -Aktivite ilişkisi Özet: Sistein proteaz (cruzain) inhibitörü olan semi-karbozonlarm yapı aktivite ilişkisinin incelenmesi elektron topoloji yöntemi (ETM) ile yapıldı. Moleküler mekanik (MMP2) ve yarı deneysel kuantum kimyasal hesaplamalardan (AMI) elde edilen veriler kullanılarak Elektron topoloji uygunluk matrisi oluşturuldu. Aktiviteye neden olan farmakofor özellikler ve aktiviteyi bozan antifarmakofor özellikler açıklandı. Cu, Ni, Go ile bazı semikarbazonlann elektronik parametreleri incelendi ve bu komplekslerin yapı aktivite ilişkisi ile çalışıldı. ıı | |
| dc.description.abstract | INVESTIGATION OF STRUCTURE ACTIVITY RELATIONSHIPS OF THIOSEMICARÖAZONE and METAL COMPLEXES with ELECTRONIC TOPOLOGICAL METHOD İlknur ÇAVUŞO?LU Keywords :Electronic-Topological Method, Trypanocidal Thio Semicarbazone Inhibitors, Structure-Activity Relationship Abstract: The structure activity relationship of a series of potent thio semicarbazone small-molecule inhibitors of the Trypanosoma cruzi cysteine protease cruzain was investigated by using Electron Topological Method (ETM). Electronic-Topological Matrices of Conjunction (ETMCs) were formed by using data obtained from molecular mechanics (MMP2) and semi-empirical quantum chemistry (AMI). Pharmacophore features causing activity and antipharmacophore ones breaking activity were explained. Electronic parameters of some complex compounds of semicarbazone with Cu, Ni Co were investigated and studied Structure-Activity relationships of these complexes. m | en_US |
| dc.language | Turkish | |
| dc.language.iso | tr | |
| dc.rights | info:eu-repo/semantics/embargoedAccess | |
| dc.rights | Attribution 4.0 United States | tr_TR |
| dc.rights.uri | https://creativecommons.org/licenses/by/4.0/ | |
| dc.subject | Kimya | tr_TR |
| dc.subject | Chemistry | en_US |
| dc.title | Tiyosemikarbazon ve metal komplekslerinin yapı aktivite ilişkisinin elektron topoloji yöntemiyle incelenmesi | |
| dc.title.alternative | Investigation of structure activity relationships of thiosemicarbazone and metal com with electronic topological method | |
| dc.type | masterThesis | |
| dc.date.updated | 2018-08-06 | |
| dc.contributor.department | Kimya Anabilim Dalı | |
| dc.identifier.yokid | 172763 | |
| dc.publisher.institute | Fen Bilimleri Enstitüsü | |
| dc.publisher.university | KOCAELİ ÜNİVERSİTESİ | |
| dc.identifier.thesisid | 155105 | |
| dc.description.pages | 104 | |
| dc.publisher.discipline | Diğer |
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