Please use this identifier to cite or link to this item: https://hdl.handle.net/20.500.11851/5880
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dc.contributor.authorTuna, O.-
dc.contributor.authorKuyucak, S.-
dc.contributor.authorBaştuğ, T.-
dc.date.accessioned2021-09-11T15:20:32Z-
dc.date.available2021-09-11T15:20:32Z-
dc.date.issued2016en_US
dc.identifier.issn2164-6457-
dc.identifier.urihttps://doi.org/10.5890/JAND.2016.03.004-
dc.identifier.urihttps://hdl.handle.net/20.500.11851/5880-
dc.description.abstractPeptide toxins offer new avenues for development of novel drugs. A- Conotoxin SI, which binds to neuromuscular Nicotinic Acetylcholine Receptor, is such an analgesic drug candidate. Understanding the mechanism of action is crucial for improving the properties of drug candidates. Here, we use docking and molecular dynamics simula- tions to propose a model for binding of A-Conotoxin SI to Nicotinic Acetylcholine Receptor and discuss its paralysis effect. © 2016. L&H Scientific Publishing, LLC.en_US
dc.language.isoenen_US
dc.publisherL and H Scientific Publishing, LLCen_US
dc.relation.ispartofJournal of Applied Nonlinear Dynamicsen_US
dc.rightsinfo:eu-repo/semantics/closedAccessen_US
dc.subjectDrug discoveryen_US
dc.subjectMolecular dynamicsen_US
dc.subjectPotential of mean forceen_US
dc.subjectProtein-ligand interactionsen_US
dc.titleParalysis mechanism of A-conotoxin si from molecular dynamics simulations and free energy calculationsen_US
dc.typeArticleen_US
dc.departmentFaculties, Faculty of Engineering, Department of Material Science and Nanotechnology Engineeringen_US
dc.departmentFakülteler, Mühendislik Fakültesi, Malzeme Bilimi ve Nanoteknoloji Mühendisliği Bölümütr_TR
dc.identifier.volume5en_US
dc.identifier.issue1en_US
dc.identifier.startpage59en_US
dc.identifier.endpage64en_US
dc.identifier.scopus2-s2.0-85020188694en_US
dc.institutionauthorBaştuğ, Turgut-
dc.identifier.doi10.5890/JAND.2016.03.004-
dc.relation.publicationcategoryMakale - Uluslararası Hakemli Dergi - Kurum Öğretim Elemanıen_US
dc.identifier.scopusqualityQ3-
item.cerifentitytypePublications-
item.fulltextNo Fulltext-
item.grantfulltextnone-
item.openairetypeArticle-
item.languageiso639-1en-
item.openairecristypehttp://purl.org/coar/resource_type/c_18cf-
crisitem.author.dept02.6. Department of Material Science and Nanotechnology Engineering-
Appears in Collections:Malzeme Bilimi ve Nanoteknoloji Mühendisliği Bölümü / Department of Material Science & Nanotechnology Engineering
Scopus İndeksli Yayınlar Koleksiyonu / Scopus Indexed Publications Collection
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