Characteristics studies of molecular structures in drugs

In theoretical medicine, topological indices are defined to test the medicine and pharmacy characteristics, such as melting point, boiling point, toxicity and other biological activities. As basic molecular structures, hexagonal jagged-rectangle and distance-regular structure are widely appeared in...

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Detalles Bibliográficos
Autores principales: Gao, Wei, Wang, Yiqiao, Basavanagoud, B., Jamil, Muhammad Kamran
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Elsevier 2017
Materias:
Original Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5447454/
https://www.ncbi.nlm.nih.gov/pubmed/28579895
http://dx.doi.org/10.1016/j.jsps.2017.04.027
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author Gao, Wei
Wang, Yiqiao
Basavanagoud, B.
Jamil, Muhammad Kamran
author_facet Gao, Wei
Wang, Yiqiao
Basavanagoud, B.
Jamil, Muhammad Kamran
author_sort Gao, Wei
collection PubMed
description In theoretical medicine, topological indices are defined to test the medicine and pharmacy characteristics, such as melting point, boiling point, toxicity and other biological activities. As basic molecular structures, hexagonal jagged-rectangle and distance-regular structure are widely appeared in medicine, pharmacy and biology engineering. In this paper, we study the chemical properties of hexagonal jagged-rectangle from the mathematical point of view. Several vertex distance-based indices are determined. Furthermore, the Wiener related indices of distance-regular structure are also considered.
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spelling pubmed-54474542017-06-02 Characteristics studies of molecular structures in drugs Gao, Wei Wang, Yiqiao Basavanagoud, B. Jamil, Muhammad Kamran Saudi Pharm J Original Article In theoretical medicine, topological indices are defined to test the medicine and pharmacy characteristics, such as melting point, boiling point, toxicity and other biological activities. As basic molecular structures, hexagonal jagged-rectangle and distance-regular structure are widely appeared in medicine, pharmacy and biology engineering. In this paper, we study the chemical properties of hexagonal jagged-rectangle from the mathematical point of view. Several vertex distance-based indices are determined. Furthermore, the Wiener related indices of distance-regular structure are also considered. Elsevier 2017-05 2017-05-09 /pmc/articles/PMC5447454/ /pubmed/28579895 http://dx.doi.org/10.1016/j.jsps.2017.04.027 Text en © 2017 The Authors. Production and hosting by Elsevier B.V. on behalf of King Saud University. http://creativecommons.org/licenses/by-nc-nd/4.0/ This is an open access article under the CC BY-NC-ND license (http://creativecommons.org/licenses/by-nc-nd/4.0/).
spellingShingle Original Article
Gao, Wei
Wang, Yiqiao
Basavanagoud, B.
Jamil, Muhammad Kamran
Characteristics studies of molecular structures in drugs
title Characteristics studies of molecular structures in drugs
title_full Characteristics studies of molecular structures in drugs
title_fullStr Characteristics studies of molecular structures in drugs
title_full_unstemmed Characteristics studies of molecular structures in drugs
title_short Characteristics studies of molecular structures in drugs
title_sort characteristics studies of molecular structures in drugs
topic Original Article
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5447454/
https://www.ncbi.nlm.nih.gov/pubmed/28579895
http://dx.doi.org/10.1016/j.jsps.2017.04.027
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