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Two-dimensional phthalocyanine frameworks: Topological descriptors, predictive models for physical properties and comparative analysis of entropies with different computational methods

J. Singh Junias, Joseph Clement, M. P. Rahul, Micheal Arockiaraj

2024Computational Materials Science24 citationsDOI

Topics & Concepts

PhthalocyanineNanostructureMaterials sciencePorphyrinQuantitative structure–activity relationshipComputer scienceTopology (electrical circuits)Computational chemistryBiological systemChemistryNanotechnologyMathematicsMachine learningOrganic chemistryBiologyCombinatoricsGraph theory and applicationsConducting polymers and applicationsSynthesis and Properties of Aromatic Compounds
Two-dimensional phthalocyanine frameworks: Topological descriptors, predictive models for physical properties and comparative analysis of entropies with different computational methods | Litcius