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Computer generation of acyclic graphs based on local vertex invariants and topological indices. Derived canonical labelling and coding of trees and alkanes
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What this work says
Outgoing claims: the papers this work cites, builds on, or argues with.
inferredcites →https://doi.org/10.1002/ange.19881001204openalex-snapshot
Die chemische Veröffentlichung – Entwicklung oder Erstarrung im Rituellen?
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Computer enumeration and generation of benzenoid hydrocarbons and identification of bay regions
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Combinatorial Enumeration of Groups, Graphs, and Chemical Compounds
inferredcites →https://doi.org/10.1007/bf01166951openalex-snapshot
New vertex invariants and topological indices of chemical graphs based on information on distances
inferredcites →https://doi.org/10.1007/bf01205338openalex-snapshot
A new approach for devising local graph invariants: Derived topological indices with low degeneracy and good correlation ability
inferredcites →https://doi.org/10.1007/bf02546665openalex-snapshot
Kombinatorische Anzahlbestimmungen für Gruppen, Graphen und chemische Verbindungen
inferredcites →https://doi.org/10.1007/bfb0111212openalex-snapshot
Topological indices for structure-activity correlations
inferredcites →https://doi.org/10.1016/0009-2614(82)80009-2openalex-snapshot
Highly discriminating distance-based topological index
inferredcites →https://doi.org/10.1016/0166-1280(88)87023-4openalex-snapshot
Topological indices and their uses: A new approach for the coding of alkanes
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Branching in graphs and molecules
inferredcites →https://doi.org/10.1016/b978-0-12-406560-4.x5001-6openalex-snapshot
Molecular Connectivity in Chemistry and Drug Research
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The codifying of tree-structure
inferredcites →https://doi.org/10.1021/c160017a018openalex-snapshot
The Generation of a Unique Machine Description for Chemical Structures-A Technique Developed at Chemical Abstracts Service.
inferredcites →https://doi.org/10.1021/ci00001a012openalex-snapshot
The electrotopological state: structure information at the atomic level for molecular graphs
inferredcites →https://doi.org/10.1021/ci00001a018openalex-snapshot
Generation and enumeration of carbon skeletons
inferredcites →https://doi.org/10.1021/ci00030a009openalex-snapshot
Computer enumeration and generation of trees and rooted trees
inferredcites →https://doi.org/10.1021/ci00032a004openalex-snapshot
Graph potentials method and its application for chemical information processing
inferredcites →https://doi.org/10.1021/ci00033a007openalex-snapshot
Exhaustive generation of structural isomers for a given empirical formula - a new algorithm
inferredcites →https://doi.org/10.1021/ci00039a006openalex-snapshot
A new system for the designation of chemical compounds. 1. Theoretical preliminaries and the coding of acyclic compounds
inferredcites →https://doi.org/10.1021/ci00066a001openalex-snapshot
Canonical indexing and constructive enumeration of molecular graphs
inferredcites →https://doi.org/10.1021/ci60004a003openalex-snapshot
The Scope of Structural Isomerism
inferredcites →https://doi.org/10.1021/ci60005a015openalex-snapshot
A Structural Isomers Enumeration and Display System (SIEDS)
inferredcites →https://doi.org/10.1021/ja00832a017openalex-snapshot
Applications of artificial intelligence for chemical inference. XII. Exhaustive generation of cyclic and acyclic isomers
inferredcites →https://doi.org/10.1021/ja00856a001openalex-snapshot
Characterization of molecular branching
inferredcites →https://doi.org/10.1021/ja01359a027openalex-snapshot
THE NUMBER OF STRUCTURALLY ISOMERIC ALCOHOLS OF THE METHANOL SERIES
inferredcites →https://doi.org/10.1021/ja01359a034openalex-snapshot
THE NUMBER OF ISOMERIC HYDROCARBONS OF THE METHANE SERIES
inferredcites →https://doi.org/10.1063/1.434593openalex-snapshot
Information theory, distance matrix, and molecular branching
inferredcites →https://doi.org/10.1080/14786447408641058openalex-snapshot
LVII. On the mathematical theory of isomers
What points at this work
Incoming claims: where this work appears in other papers’ reference lists and arguments.
inferred← citeshttps://doi.org/10.1007/978-3-642-17517-6_18openalex-snapshot
Generating Trees on Multisets
inferred← citeshttps://doi.org/10.1007/bf01164638openalex-snapshot
On the Harary index for the characterization of chemical graphs
inferred← citeshttps://doi.org/10.1007/bf01164642openalex-snapshot
Design of topological indices. Part 4. Reciprocal distance matrix, related local vertex invariants and topological indices
inferred← citeshttps://doi.org/10.1007/bf02840911openalex-snapshot
Quantitative structure-property relationship research of main group compounds
inferred← citeshttps://doi.org/10.1007/s10288-002-0008-9openalex-snapshot
Chemical trees enumeration algorithms
inferred← citeshttps://doi.org/10.1007/s10910-022-01353-8openalex-snapshot
Dendrimer eigen-characteristics
inferred← citeshttps://doi.org/10.1016/s0009-2614(01)00127-0openalex-snapshot
Generalization of topological indices
inferred← citeshttps://doi.org/10.1016/s0166-1280(01)00772-2openalex-snapshot
QSAR for dihydrofolate reductase inhibitors with molecular graph structural descriptors
inferred← citeshttps://doi.org/10.1021/ci000068yopenalex-snapshot
QSAR Comparative Study of Wiener Descriptors for Weighted Molecular Graphs
inferred← citeshttps://doi.org/10.1021/ci000086fopenalex-snapshot
Wiener Index Extension by Counting Even/Odd Graph Distances
inferred← citeshttps://doi.org/10.1021/ci00025a001openalex-snapshot
Chemical Graphs: Looking Back and Glimpsing Ahead
inferred← citeshttps://doi.org/10.1021/ci700385aopenalex-snapshot
Enumerating Treelike Chemical Graphs with Given Path Frequency
inferred← citeshttps://doi.org/10.1021/ci900447zopenalex-snapshot
Branch-and-Bound Algorithms for Enumerating Treelike Chemical Graphs with Given Path Frequency Using Detachment-Cut
inferred← citeshttps://doi.org/10.1021/ci950082oopenalex-snapshot
Indicators for Atoms Included in Cycles
inferred← citeshttps://doi.org/10.1021/ci970021lopenalex-snapshot
Design of Topological Indices. Part 10. Parameters Based on Electronegativity and Covalent Radius for the Computation of Molecular Graph Descriptors for Heteroatom-Containing Molecules
inferred← citeshttps://doi.org/10.1021/ci990064xopenalex-snapshot
Quasi-orthogonal Basis Sets of Molecular Graph Descriptors as a Chemical Diversity Measure
inferred← citeshttps://doi.org/10.1021/ci990085ropenalex-snapshot
Isomer Generation: Semantic Rules for Detection of Isomorphism
inferred← citeshttps://doi.org/10.1021/ci9900884openalex-snapshot
Evaluation in Quantitative Structure−Property Relationship Models of Structural Descriptors Derived from Information-Theory Operators
inferred← citeshttps://doi.org/10.1021/ci990129wopenalex-snapshot
Comparison of Weighting Schemes for Molecular Graph Descriptors: Application in Quantitative Structure−Retention Relationship Models for Alkylphenols in Gas−Liquid Chromatography
inferred← citeshttps://doi.org/10.1021/ci990149yopenalex-snapshot
Identification of Groupings of Graph Theoretical Molecular Descriptors Using a Hybrid Cluster Analysis Approach
inferred← citeshttps://doi.org/10.1023/a:1019143307939openalex-snapshot
On structural ordering and branching of acyclic saturated hydrocarbons
inferred← citeshttps://doi.org/10.1080/10629360108035362openalex-snapshot
Quantitative Structure-Retention Relationships for Gas Chromatographic Retention Indices of Alkylbenzenes with Molecular Graph Descriptors
inferred← citeshttps://doi.org/10.1080/10629360108035368openalex-snapshot
Quantitative Structure-Property Relationships Generated with Optimizable Even/Odd Wiener Polynomial Descriptors
inferred← citeshttps://doi.org/10.1080/10629369708039125openalex-snapshot
Molecular Graph Matrices and Derived Structural Descriptors
inferred← citeshttps://doi.org/10.1155/2014/742121openalex-snapshot
The Wiener Index of Circulant Graphs
inferred← citeshttps://doi.org/10.1201/b18389openalex-snapshot
Graph-Theoretical Matrices in Chemistry
inferred← citeshttps://doi.org/10.1515/auom-2017-0036openalex-snapshot
Some spectral bounds for the harmonic matrix
inferred← citeshttps://doi.org/10.1515/spma-2024-0023openalex-snapshot
On the Harary Estrada index of graphs
inferred← citeshttps://doi.org/10.1587/transinf.e94.d.211openalex-snapshot
Generation of Symmetric and Asymmetric Biconnected Rooted Outerplanar Graphs
inferred← citeshttps://doi.org/10.4204/eptcs.204.4openalex-snapshot
Generation, Ranking and Unranking of Ordered Trees with Degree Bounds
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Boiling Points Predictions Study via Dimension Reduction Methods: SIR, PCR and PLSR
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