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Concept
Molecular Graph
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Summary
A
Molecular Graph
is a
Graphical Representation
of the
Atomic Structure
of a molecule, where atoms are
Depicted as vertices
and
Bonds as edges
. This abstraction is crucial for
Computational Chemistry
and cheminformatics, enabling the analysis of
Molecular Properties
and behavior through
Graph-theoretical approaches
.
Concepts
Graph Theory
Vertices
Edges
Cheminformatics
Computational Chemistry
Molecular Structure
Chemical Bonds
Topology
Adjacency Matrix
Molecular Modeling
Topological Indices
Chemical Graph Theory
Randic Index
Zagreb Index
Topological Index
Molecular Topology
Relevant Degrees
Nuclear Physics 40%
Physical Chemistry 30%
Organic Chemistry 20%
Computational Mathematics 10%
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