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: | , , , |
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| Lenguaje: | English |
| Publicado: |
Universidad Católica del Norte, Departamento de Matemáticas
2020
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| Materias: | |
| Acceso en línea: | http://www.scielo.cl/scielo.php?script=sci_arttext&pid=S0716-09172020000501347 |
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| Sumario: | 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. |
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