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dc.date.accessioned 2022-02-21T12:33:39Z
dc.date.available 2022-02-21T12:33:39Z
dc.date.issued 2001
dc.identifier.uri http://sedici.unlp.edu.ar/handle/10915/131361
dc.description.abstract Maximum topological distance-based indices are used together with standard ones to compute the hydrophobicity of polyaromatic hydrocarbons. Several variables and higher-order regression equations are computed and shown to be excellent predictors for the chosen physical-chemistry property. This new alternative offers advantages the usual manner of deriving global topological indices for QSPR. Some possible future extensions are pointed out. en
dc.format.extent 178-183 es
dc.language en es
dc.subject Detour matrix es
dc.subject Hydrophobicity es
dc.subject Topological indices es
dc.subject Polyaromatic hydrocarbons es
dc.subject QSAR/QSPR theory es
dc.title Maximum topological distance-based indices as molecular descriptors for QSPR 3 en
dc.type Articulo es
sedici.identifier.other doi:10.1007/s008940100029 es
sedici.identifier.issn 1610-2940 es
sedici.identifier.issn 0948-5023 es
sedici.title.subtitle Calculation of the hydrophobicity of polyaromatic hydrocarbons en
sedici.creator.person Tueros, Matías Jorge es
sedici.creator.person Castro, Eduardo Alberto es
sedici.creator.person Toropov, Andrey A. es
sedici.subject.materias Química es
sedici.description.fulltext true es
mods.originInfo.place Centro de Química Inorgánica es
sedici.subtype Articulo es
sedici.rights.license Creative Commons Attribution-NonCommercial-ShareAlike 4.0 International (CC BY-NC-SA 4.0)
sedici.rights.uri http://creativecommons.org/licenses/by-nc-sa/4.0/
sedici.description.peerReview peer-review es
sedici.relation.journalTitle Journal of Molecular Modeling es
sedici.relation.journalVolumeAndIssue vol. 7, no. 6 es


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Creative Commons Attribution-NonCommercial-ShareAlike 4.0 International (CC BY-NC-SA 4.0) Excepto donde se diga explícitamente, este item se publica bajo la siguiente licencia Creative Commons Attribution-NonCommercial-ShareAlike 4.0 International (CC BY-NC-SA 4.0)