Multiplicative degree based topological indices of some chemical structures in drug

Abstract In quantitative structure property relationship analysis (QSPR) and quantitative structure property relationship analysis (QSAR) the correlation between different properties/activities and molecular structure of chemical compounds is investigated which is helpful in drug design. Topological...

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Autores principales: Cancan,Murat, Mondal,Sourav, De,Nilanjan, Pal,Anita
Lenguaje:English
Publicado: Universidad Católica del Norte, Departamento de Matemáticas 2020
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Acceso en línea:http://www.scielo.cl/scielo.php?script=sci_arttext&pid=S0716-09172020000501347
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spelling oai:scielo:S0716-091720200005013472020-11-16Multiplicative degree based topological indices of some chemical structures in drugCancan,MuratMondal,SouravDe,NilanjanPal,Anita Topological index Dox-loaded micelle comprising PEGPAsp block copolymer with chemically conjugated Dox SP[n] Polyomino chain of n-cycles Triangular benzenoid (Tn) Circumcoronene benzenoid series (Hk) Abstract In quantitative structure property relationship analysis (QSPR) and quantitative structure property relationship analysis (QSAR) the correlation between different properties/activities and molecular structure of chemical compounds is investigated which is helpful in drug design. Topological index is an useful tool to predict different physical and chemical properties of molecule by collecting information from the molecular graph. In this article, multiplicative degree based topological indices are obtained for some chemical structures widely used in drug design, especially in anticancer drug discovery. To visualize the indices, the results are interpreted graphically.info:eu-repo/semantics/openAccessUniversidad Católica del Norte, Departamento de MatemáticasProyecciones (Antofagasta) v.39 n.5 20202020-01-01text/htmlhttp://www.scielo.cl/scielo.php?script=sci_arttext&pid=S0716-09172020000501347en10.22199/issn.0717-6279-2020-05-0082
institution Scielo Chile
collection Scielo Chile
language English
topic Topological index
Dox-loaded micelle comprising PEGPAsp block copolymer with chemically conjugated Dox SP[n]
Polyomino chain of n-cycles
Triangular benzenoid (Tn)
Circumcoronene benzenoid series (Hk)
spellingShingle Topological index
Dox-loaded micelle comprising PEGPAsp block copolymer with chemically conjugated Dox SP[n]
Polyomino chain of n-cycles
Triangular benzenoid (Tn)
Circumcoronene benzenoid series (Hk)
Cancan,Murat
Mondal,Sourav
De,Nilanjan
Pal,Anita
Multiplicative degree based topological indices of some chemical structures in drug
description Abstract In quantitative structure property relationship analysis (QSPR) and quantitative structure property relationship analysis (QSAR) the correlation between different properties/activities and molecular structure of chemical compounds is investigated which is helpful in drug design. Topological index is an useful tool to predict different physical and chemical properties of molecule by collecting information from the molecular graph. In this article, multiplicative degree based topological indices are obtained for some chemical structures widely used in drug design, especially in anticancer drug discovery. To visualize the indices, the results are interpreted graphically.
author Cancan,Murat
Mondal,Sourav
De,Nilanjan
Pal,Anita
author_facet Cancan,Murat
Mondal,Sourav
De,Nilanjan
Pal,Anita
author_sort Cancan,Murat
title Multiplicative degree based topological indices of some chemical structures in drug
title_short Multiplicative degree based topological indices of some chemical structures in drug
title_full Multiplicative degree based topological indices of some chemical structures in drug
title_fullStr Multiplicative degree based topological indices of some chemical structures in drug
title_full_unstemmed Multiplicative degree based topological indices of some chemical structures in drug
title_sort multiplicative degree based topological indices of some chemical structures in drug
publisher Universidad Católica del Norte, Departamento de Matemáticas
publishDate 2020
url http://www.scielo.cl/scielo.php?script=sci_arttext&pid=S0716-09172020000501347
work_keys_str_mv AT cancanmurat multiplicativedegreebasedtopologicalindicesofsomechemicalstructuresindrug
AT mondalsourav multiplicativedegreebasedtopologicalindicesofsomechemicalstructuresindrug
AT denilanjan multiplicativedegreebasedtopologicalindicesofsomechemicalstructuresindrug
AT palanita multiplicativedegreebasedtopologicalindicesofsomechemicalstructuresindrug
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