A chemometric approach for prediction of antifungal activity of some benzoxazole derivatives against Candida albicans
The purpose of the article is to promote and facilitate prediction of antifungal activity of the investigated series of benzoxazoles against Candida albicans. The clinical importance of this investigation is to simplify design of new antifungal agents against the fungi which can cause serious il...
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| Format: | Article |
| Language: | English |
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Faculty of Technology, Novi Sad
2012-01-01
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| Series: | Acta Periodica Technologica |
| Subjects: | |
| Online Access: | http://www.doiserbia.nb.rs/img/doi/1450-7188/2012/1450-71881243273P.pdf |
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| author | Podunavac-Kuzmanović Sanja O. Jevrić Lidija J. Kovačević Strahinja Z. Kalajdžija Nataša D. |
| author_facet | Podunavac-Kuzmanović Sanja O. Jevrić Lidija J. Kovačević Strahinja Z. Kalajdžija Nataša D. |
| author_sort | Podunavac-Kuzmanović Sanja O. |
| collection | DOAJ |
| description | The purpose of the article is to promote and facilitate prediction of antifungal activity of the investigated series of benzoxazoles against Candida albicans. The clinical importance of this investigation is to simplify design of new antifungal agents against the fungi which can cause serious illnesses in humans. Quantitative structure activity relationship analysis was applied on nineteen benzoxazole derivatives. A multiple linear regression (MLR) procedure was used to model the relationships between the molecular descriptors and the antifungal activity of benzoxazole derivatives. Two mathematical models have been developed as a calibration models for predicting the inhibitory activity of this class of compounds against Candida albicans. The quality of the models was validated by the leave-one-out technique, as well as by the calculation of statistical parameters for the established model. [Projekat Ministarstva nauke Republike Srbije, br. 172012 i br. 172014] |
| first_indexed | 2024-12-11T13:04:27Z |
| format | Article |
| id | doaj.art-596d947e9dfe484fbe86d9eca75f40d2 |
| institution | Directory Open Access Journal |
| issn | 1450-7188 |
| language | English |
| last_indexed | 2024-12-11T13:04:27Z |
| publishDate | 2012-01-01 |
| publisher | Faculty of Technology, Novi Sad |
| record_format | Article |
| series | Acta Periodica Technologica |
| spelling | doaj.art-596d947e9dfe484fbe86d9eca75f40d22022-12-22T01:06:22ZengFaculty of Technology, Novi SadActa Periodica Technologica1450-71882012-01-0120124327328210.2298/APT1243273PA chemometric approach for prediction of antifungal activity of some benzoxazole derivatives against Candida albicansPodunavac-Kuzmanović Sanja O.Jevrić Lidija J.Kovačević Strahinja Z.Kalajdžija Nataša D.The purpose of the article is to promote and facilitate prediction of antifungal activity of the investigated series of benzoxazoles against Candida albicans. The clinical importance of this investigation is to simplify design of new antifungal agents against the fungi which can cause serious illnesses in humans. Quantitative structure activity relationship analysis was applied on nineteen benzoxazole derivatives. A multiple linear regression (MLR) procedure was used to model the relationships between the molecular descriptors and the antifungal activity of benzoxazole derivatives. Two mathematical models have been developed as a calibration models for predicting the inhibitory activity of this class of compounds against Candida albicans. The quality of the models was validated by the leave-one-out technique, as well as by the calculation of statistical parameters for the established model. [Projekat Ministarstva nauke Republike Srbije, br. 172012 i br. 172014]http://www.doiserbia.nb.rs/img/doi/1450-7188/2012/1450-71881243273P.pdfchemometricsantifungalsbenzoxazole derivativesCandida albicansmolecular descriptors |
| spellingShingle | Podunavac-Kuzmanović Sanja O. Jevrić Lidija J. Kovačević Strahinja Z. Kalajdžija Nataša D. A chemometric approach for prediction of antifungal activity of some benzoxazole derivatives against Candida albicans Acta Periodica Technologica chemometrics antifungals benzoxazole derivatives Candida albicans molecular descriptors |
| title | A chemometric approach for prediction of antifungal activity of some benzoxazole derivatives against Candida albicans |
| title_full | A chemometric approach for prediction of antifungal activity of some benzoxazole derivatives against Candida albicans |
| title_fullStr | A chemometric approach for prediction of antifungal activity of some benzoxazole derivatives against Candida albicans |
| title_full_unstemmed | A chemometric approach for prediction of antifungal activity of some benzoxazole derivatives against Candida albicans |
| title_short | A chemometric approach for prediction of antifungal activity of some benzoxazole derivatives against Candida albicans |
| title_sort | chemometric approach for prediction of antifungal activity of some benzoxazole derivatives against candida albicans |
| topic | chemometrics antifungals benzoxazole derivatives Candida albicans molecular descriptors |
| url | http://www.doiserbia.nb.rs/img/doi/1450-7188/2012/1450-71881243273P.pdf |
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