QSAR Model for Predicting Antioxidan Capacity of Some Polyphenolic Antioxidants
Abstract
Quantitative structure–activity relationship model (QSAR models) is useful method for predicting antioxidant capacity of a molecule based on some chemical-physics properties. In our development of QSAR model are included 21 structural similar antioxidants. It is shown that taking into account some thermodynamical and thermochemical parameters of antioxidant and chemical activity is possible to generate fair antiradical QSAR models.
Keywords:
antioxidant activity / thermodynamical parameters / QSAR / VCEAC / nOHvicSource:
21. Savetovanje o biotehnologiji sa međunarodnim učešćem, Čačak, 11.- 12. 03. 2016., 2016Funding / projects:
- Dynamics of nonlinear physicochemical and biochemical systems with modeling and predicting of their behavior under nonequilibrium conditions (RS-MESTD-Basic Research (BR or ON)-172015)
- Multiscale Methods and Their Applicatios in Nanomedicine (RS-MESTD-Basic Research (BR or ON)-174028)
Collections
Institution/Community
Poljoprivredni fakultetTY - CONF AU - Marković, Zoran AU - Jeremić, Svetlana AU - Filipović, Miloš AU - Milenković, Dejan AU - Djorović, Jelena PY - 2016 UR - http://aspace.agrif.bg.ac.rs/handle/123456789/5623 AB - Quantitative structure–activity relationship model (QSAR models) is useful method for predicting antioxidant capacity of a molecule based on some chemical-physics properties. In our development of QSAR model are included 21 structural similar antioxidants. It is shown that taking into account some thermodynamical and thermochemical parameters of antioxidant and chemical activity is possible to generate fair antiradical QSAR models. C3 - 21. Savetovanje o biotehnologiji sa međunarodnim učešćem, Čačak, 11.- 12. 03. 2016. T1 - QSAR Model for Predicting Antioxidan Capacity of Some Polyphenolic Antioxidants UR - https://hdl.handle.net/21.15107/rcub_agrospace_5623 ER -
@conference{ author = "Marković, Zoran and Jeremić, Svetlana and Filipović, Miloš and Milenković, Dejan and Djorović, Jelena", year = "2016", abstract = "Quantitative structure–activity relationship model (QSAR models) is useful method for predicting antioxidant capacity of a molecule based on some chemical-physics properties. In our development of QSAR model are included 21 structural similar antioxidants. It is shown that taking into account some thermodynamical and thermochemical parameters of antioxidant and chemical activity is possible to generate fair antiradical QSAR models.", journal = "21. Savetovanje o biotehnologiji sa međunarodnim učešćem, Čačak, 11.- 12. 03. 2016.", title = "QSAR Model for Predicting Antioxidan Capacity of Some Polyphenolic Antioxidants", url = "https://hdl.handle.net/21.15107/rcub_agrospace_5623" }
Marković, Z., Jeremić, S., Filipović, M., Milenković, D.,& Djorović, J.. (2016). QSAR Model for Predicting Antioxidan Capacity of Some Polyphenolic Antioxidants. in 21. Savetovanje o biotehnologiji sa međunarodnim učešćem, Čačak, 11.- 12. 03. 2016.. https://hdl.handle.net/21.15107/rcub_agrospace_5623
Marković Z, Jeremić S, Filipović M, Milenković D, Djorović J. QSAR Model for Predicting Antioxidan Capacity of Some Polyphenolic Antioxidants. in 21. Savetovanje o biotehnologiji sa međunarodnim učešćem, Čačak, 11.- 12. 03. 2016.. 2016;. https://hdl.handle.net/21.15107/rcub_agrospace_5623 .
Marković, Zoran, Jeremić, Svetlana, Filipović, Miloš, Milenković, Dejan, Djorović, Jelena, "QSAR Model for Predicting Antioxidan Capacity of Some Polyphenolic Antioxidants" in 21. Savetovanje o biotehnologiji sa međunarodnim učešćem, Čačak, 11.- 12. 03. 2016. (2016), https://hdl.handle.net/21.15107/rcub_agrospace_5623 .