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Research Article

Topological Indices Of Molecular Graphs Under Specific Chemical Reactions


Author(s): S. Ramakrishnan , J. Senbagamalar,J. Baskar Babujee
Affiliation: Department of Mathematics, Sri Sai Ram Engineering College, Chennai 600 044, India
Year of Publication: 2013
Source: International Journal of Computing Algorithm
     
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Citation: S. Ramakrishnan, J. Senbagamalar,J. Baskar Babujee. "Topological Indices Of Molecular Graphs Under Specific Chemical Reactions." International Journal of Computing Algorithm 2.1 (2013): 68-74.

Abstract:
Molecular graph serves as a convenient model for any real or abstract chemical compound. A topological index is the graph invariant number calculated from the graph representing the molecule. The advantage of topological indices is that it may be used directly as simple numerical descriptors in QSPR/QSAR models. Most of the topological descriptors are based either on atom-atom connectivity or on topological distances. A chemical reaction can be represented as the transformation of the chemical Molecular graph representing the reaction’s substrate into another chemical graph representing the product.


Keywords Graph, Molecules, Distance matrix, Topological indices, Wiener Index, Platt number.


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@article{Top1396567, author = {S. Ramakrishnan,J. Senbagamalar,J. Baskar Babujee}, title = {Topological Indices Of Molecular Graphs Under Specific Chemical Reactions}, journal={International Journal of Computing Algorithm}, volume={2}, issue={1}, issn = {2278-2397}, year = {2013}, publisher = {Scholarly Citation Index Analytics-SCIA}

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