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https://scidar.kg.ac.rs/handle/123456789/13784
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Поље DC-а | Вредност | Језик |
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dc.rights.license | openAccess | - |
dc.contributor.author | Đorović Jovanović, Jelena | - |
dc.contributor.author | Dimić, Dušan | - |
dc.contributor.author | Stanojević Pirković, Marijana | - |
dc.contributor.author | Jeremić, Svetlana | - |
dc.contributor.author | Milenković, Dejan | - |
dc.date.accessioned | 2021-12-09T10:40:16Z | - |
dc.date.available | 2021-12-09T10:40:16Z | - |
dc.date.issued | 2021 | - |
dc.identifier.isbn | 9788682172017 | en_US |
dc.identifier.uri | https://scidar.kg.ac.rs/handle/123456789/13784 | - |
dc.description.abstract | The molecular docking study was performed with aim to examine the inhibitory potency of two selected cyclohexadiene derivatives (cis-(1S)-3-Fluoro-3,5-cyclohexadiene-1,2-diol (1), and 1,1'-(3,5-Cyclohexadiene-1,3-diyl)dibenzene (2)). The inhibitory potency of compounds 1 and 2 was investigated toward Urokinase Type Plasminogen Activator (uPa). For this purpose AutoDock 4.0 software was used. The thermodynamic parameters achieved from molecular docking simulations, free energy of binding (ΔGbind) and inhibition constant (Ki), are analyzed and discussed. The compound 2 shows better inhibitory potency through uPa, than compound 1. | en_US |
dc.publisher | Institute for Information Technologies | en_US |
dc.rights | info:eu-repo/semantics/openAccess | - |
dc.rights.uri | https://creativecommons.org/licenses/by-nc-nd/4.0/ | - |
dc.source | 1st International Conference on Chemo and BioInformatics, ICCBIKG 2021 | en_US |
dc.subject | molecular docking | en_US |
dc.subject | cyclohexadiene derivatives | en_US |
dc.title | MOLECULAR DOCKING ANALYSES OF SOME CYCLOHEXADIENE DERIVATIVES | en_US |
dc.type | conferenceObject | en_US |
dc.description.version | Published | en_US |
dc.identifier.doi | 10.46793/ICCBI21.423DJ | en_US |
dc.type.version | PublishedVersion | en_US |
Налази се у колекцијама: | Institute for Information Technologies, Kragujevac |
Датотеке у овој ставци:
Датотека | Опис | Величина | Формат | |
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MOLECULAR DOCKING ANALYSES OF SOME CYCLOHEXADIENE DERIVATIVES.pdf | 589.24 kB | Adobe PDF | ![]() Погледајте |
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