Powered by OpenAIRE graph
Found an issue? Give us feedback
addClaim

Counting Chemical Structures Resembling Trees

Authors: Athira Selvam; Sravya K. V. S. P. Sai; Bhadrachalam Chitturi;

Counting Chemical Structures Resembling Trees

Abstract

Trees have been used for counting chemical structures of non-isomorphic forms. Graph enumeration can be either isomorphic or non-isomorphic. Isomorphic tree enumeration arises in the context of listing all isomorphic subtrees of a given graph whereas non-isomorphic enumeration lists all unique trees that satisfy given constraints. We study the chemical structures that grow like a tree. They grow from a center, layer by layer, and expand in a star like manner where all vertices at layer $l$ are $l$ hops from the root. We presume that the tree is rooted at the center where the center can be either an edge or a vertex. A subtree rooted at an immediate child of the root is called as a branch. A cluster in a particular layer $j$ is the number of descendants of a particular branch in layer $j$ . Each layer is characterized by its largest cluster. We count the chemical structures, i.e. star-shaped polymers that meet the constraints that are defined in terms of the largest cluster. We define the notion of balance in trees and seek to count the number of balanced trees (i.e. polymers) when all trees (polymers) are presumed to be possible.

Related Organizations
  • BIP!
    Impact byBIP!
    selected citations
    These citations are derived from selected sources.
    This is an alternative to the "Influence" indicator, which also reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
    0
    popularity
    This indicator reflects the "current" impact/attention (the "hype") of an article in the research community at large, based on the underlying citation network.
    Average
    influence
    This indicator reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
    Average
    impulse
    This indicator reflects the initial momentum of an article directly after its publication, based on the underlying citation network.
    Average
Powered by OpenAIRE graph
Found an issue? Give us feedback
selected citations
These citations are derived from selected sources.
This is an alternative to the "Influence" indicator, which also reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
BIP!Citations provided by BIP!
popularity
This indicator reflects the "current" impact/attention (the "hype") of an article in the research community at large, based on the underlying citation network.
BIP!Popularity provided by BIP!
influence
This indicator reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
BIP!Influence provided by BIP!
impulse
This indicator reflects the initial momentum of an article directly after its publication, based on the underlying citation network.
BIP!Impulse provided by BIP!
0
Average
Average
Average
Upload OA version
Are you the author of this publication? Upload your Open Access version to Zenodo!
It’s fast and easy, just two clicks!