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dc.creatorErić, Slavica
dc.creatorSolmajer, Tom
dc.creatorZupan, Janja
dc.creatorNović, M
dc.creatorOblak, M
dc.creatorAgbaba, Danica
dc.date.accessioned2019-09-02T10:58:30Z
dc.date.available2019-09-02T10:58:30Z
dc.date.issued2004
dc.identifier.issn0948-5023
dc.identifier.urihttp://farfar.pharmacy.bg.ac.rs/handle/123456789/495
dc.description.abstractA quantitative structure-activity relationship study with respect to selectivity for alpha(1) adrenoreceptor subtypes (alpha(1a), alpha(1b) and alpha(1d)) of a wide series of structurally heterogeneous alpha(1) adrenoreceptor antagonists has been performed. A large variety of molecular descriptors have been calculated and then analyzed by a heuristic method. The orthogonalization of the descriptors has been applied to build the QSAR equations. Ad hoc defined shape descriptors calculated by the Connolly algorithm with respect to reference supermolecules have also been considered in the rationalization of the mechanism of the activity of the ligands acting as antagonists on all three subtypes of alpha(1) adrenoreceptors.en
dc.publisherSpringer-Verlag, New York
dc.rightsrestrictedAccess
dc.sourceJournal of Molecular Modeling
dc.subjectQSARen
dc.subjectalpha 1 adrenergic antagonistsen
dc.subjectmolecular descriptorsen
dc.titleQuantitative structure-activity relationships of alpha(1) adrenergic antagonistsen
dc.typearticle
dc.rights.licenseARR
dcterms.abstractAгбаба, Даница; Солмајер, Том; Ерић, Славица; Облак, М; Зупан, Јања; Новић, М;
dc.citation.volume10
dc.citation.issue2
dc.citation.spage139
dc.citation.epage150
dc.citation.other10(2): 139-150
dc.citation.rankM21
dc.identifier.wos000220564500007
dc.identifier.doi10.1007/s00894-003-0177-2
dc.identifier.pmid14997365
dc.identifier.scopus2-s2.0-2542481766
dc.identifier.rcubconv_1527
dc.type.versionpublishedVersion


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