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Determination of Topo-Geometrical Equivalence Classes of Atoms
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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/cem.1180060602openalex-snapshot
A review of three‐dimensional chemical structure retrieval systems
inferredcites →https://doi.org/10.1002/jcc.540060606openalex-snapshot
Unique description of chemical structures based on hierarchically ordered extended connectivities (HOC procedures). I. Algorithms for finding graph orbits and canonical numbering of atoms
inferredcites →https://doi.org/10.1002/jcc.540060607openalex-snapshot
Unique description of chemical structures on hierarchically ordered extended connectivities (HOC procedures). II. Mathematical proofs for the HOC algorithm
inferredcites →https://doi.org/10.1002/jcc.540060608openalex-snapshot
Unique description of chemical structures based on hierarchically ordered extended connectivities (HOC procedures). III. Topological, chemical, and stereochemical coding of molecular structure
inferredcites →https://doi.org/10.1002/jcc.540060611openalex-snapshot
Unique description of chemical structures based on hierarchically ordered extended connectivities (HOC procedures). VIII. General principles for computer implementation
inferredcites →https://doi.org/10.1002/jcc.540120502openalex-snapshot
Molecular topology. IV. Regressive vertex degrees (new graph invariants) and derived topological indices
inferredcites →https://doi.org/10.1002/qsar.19900090207openalex-snapshot
Determination of Topological Equivalence in Molecular Graphs from the Topological State
inferredcites →https://doi.org/10.1002/qua.560340718openalex-snapshot
On characterization of three-dimensional structures
inferredcites →https://doi.org/10.1007/bf00125665openalex-snapshot
Techniques for the calculation of three-dimensional structural similarity using inter-atomic distances
inferredcites →https://doi.org/10.1007/bf02477836openalex-snapshot
A note on the information content of graphs
inferredcites →https://doi.org/10.1007/bfb0111212openalex-snapshot
Topological indices for structure-activity correlations
inferredcites →https://doi.org/10.1016/0003-2670(94)80342-0openalex-snapshot
Algorithm for computer perception of topological symmetry
inferredcites →https://doi.org/10.1016/0009-2614(84)85406-8openalex-snapshot
Hierarchically ordered extended connectivities. reflection in the 1H NMR chemical shifts of condensed benzenoid hydrocarbons
inferredcites →https://doi.org/10.1016/0009-2614(90)85192-fopenalex-snapshot
Geometry-dependent characteristic polynomials of molecular structures
inferredcites →https://doi.org/10.1016/0009-2614(91)90285-hopenalex-snapshot
On the geometric-distance matrix and the corresponding structural invariants of molecular systems
inferredcites →https://doi.org/10.1016/0009-2614(94)01382-6openalex-snapshot
Graph theoretical perception of molecular symmetry
inferredcites →https://doi.org/10.1016/0022-2364(85)90148-9openalex-snapshot
Unique description of chemical structures based on hierarchically ordered extended connectivities. VII. Condensed benzenoid hydrocarbons and their 1H NMR chemical shifts
inferredcites →https://doi.org/10.1016/0097-8485(90)80051-3openalex-snapshot
Development of 3-dimensional molecular descriptors
inferredcites →https://doi.org/10.1016/0166-1280(91)85245-3openalex-snapshot
The algebraic modelling of chemical structures: On the development of three-dimensional molecular descriptors
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/c160017a019openalex-snapshot
A Connectivity Code for Use in Describing Chemical Structures.
inferredcites →https://doi.org/10.1021/ci00005a004openalex-snapshot
Using real numbers as vertex invariants for third-generation topological indexes
inferredcites →https://doi.org/10.1021/ci00005a005openalex-snapshot
Comparative study of molecular descriptors derived from the distance matrix
inferredcites →https://doi.org/10.1021/ci00018a028openalex-snapshot
Local versus Global (i.e. Atomic versus Molecular) Numerical Modeling of Molecular Graphs
inferredcites →https://doi.org/10.1021/ci00020a006openalex-snapshot
ESSESA: An Expert System for Structure Elucidation from Spectra. 4. Canonical Representation of Structures
inferredcites →https://doi.org/10.1021/ci00023a019openalex-snapshot
Molecular Topology. 15. 3D Distance Matrixes and Related Topological Indices
inferredcites →https://doi.org/10.1021/ci00026a015openalex-snapshot
Computer Perception of Molecular Symmetry
inferredcites →https://doi.org/10.1021/ci60010a014openalex-snapshot
Canonical Numbering and Constitutional Symmetry
inferredcites →https://doi.org/10.1021/ci60014a015openalex-snapshot
Erroneous Claims Concerning the Perception of Topological Symmetry
inferredcites →https://doi.org/10.1021/ci60014a016openalex-snapshot
Computer Design of Synthesis in Phosphorus Chemistry: Automatic Treatment of Stereochemistry
inferredcites →https://doi.org/10.1021/ci60017a012openalex-snapshot
On the Misinterpretation of Our Algorithm for the Perception of Constitutional Symmetry
inferredcites →https://doi.org/10.1021/ci9500593openalex-snapshot
Determination of Topological Equivalence Classes of Atoms and Bonds in C20−C60 Fullerenes Using a New Prolog Coding Program
inferredcites →https://doi.org/10.1021/ci9501711openalex-snapshot
Detection of Constitutionally Equivalent Sites from a Connection Table
inferredcites →https://doi.org/10.1107/s0567739478000522openalex-snapshot
Stable calculation of coordinates from distance information
inferredcites →https://doi.org/10.1107/s0567739478000534openalex-snapshot
Diffraction from dislocations and grain boundaries – an optical analogue study
What points at this work
Incoming claims: where this work appears in other papers’ reference lists and arguments.
inferred← citeshttps://doi.org/10.1002/0470845015.cca001openalex-snapshot
Canonical Numbering and Constitutional Symmetry
inferred← citeshttps://doi.org/10.1002/9783527618279.ch7aopenalex-snapshot
Canonical Numbering and Constitutional Symmetry
inferred← citeshttps://doi.org/10.1002/chin.199950259openalex-snapshot
ChemInform Abstract: Molecular Topology of Dendrimers
inferred← citeshttps://doi.org/10.1007/s11094-021-02513-xopenalex-snapshot
Quantitative Structure–Activity Relationship Analysis and Validation of New DNA Gyrase Inhibitors
inferred← citeshttps://doi.org/10.1016/s1874-5229(99)80006-9openalex-snapshot
Molecular topology of dendrimers
inferred← citeshttps://doi.org/10.1039/9781847558879-00044openalex-snapshot
Topological Pharmacophores
inferred← citeshttps://doi.org/10.1080/10629360008033232openalex-snapshot
A General13C NMR Spectrum Predictor Using Data Mining Techniques
inferred← citeshttps://doi.org/10.70675/f0cedbe1z6c18z48e4z901cza22a3ae4e98aopenalex-snapshot
Les triplets pharmacophoriques flous : développement et applications
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