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The nature of chemical structure
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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.19690812102openalex-snapshot
Die Erhaltung der Orbitalsymmetrie
inferredcites →https://doi.org/10.1002/anie.198608821openalex-snapshot
Geometric and Topological Thinking in Organic Chemistry
inferredcites →https://doi.org/10.1002/jcc.540090609openalex-snapshot
Computer assisted structure–taste studies on sulfamates by pattern recognition method using graph theoretical invariants
inferredcites →https://doi.org/10.1002/jps.2600650824openalex-snapshot
Molecular Connectivity V: Connectivity Series Concept Applied to Density
inferredcites →https://doi.org/10.1002/qua.560140724openalex-snapshot
Graph-theoretical analysis of structure-property and structure-activity correlations
inferredcites →https://doi.org/10.1002/qua.560300762openalex-snapshot
On some solved and unsolved problems of chemical graph theory
inferredcites →https://doi.org/10.1007/bf00528208openalex-snapshot
Composition as a method for data reduction: application to carbon-13 NMR chemical shifts
inferredcites →https://doi.org/10.1016/0009-2614(76)80257-6openalex-snapshot
Conjugated circuits and resonance energies of benzenoid hydrocarbons
inferredcites →https://doi.org/10.1016/0009-2614(78)80079-7openalex-snapshot
Graph theoretical analysis of diamagnetic susceptibilities of alkanes and alkenes
inferredcites →https://doi.org/10.1016/0009-2614(79)87030-xopenalex-snapshot
On a graph theoretical basis for ordering of structures
inferredcites →https://doi.org/10.1016/0027-5107(84)90001-0openalex-snapshot
Structural requirements for the mutagenicity of environmental nitroarenes
inferredcites →https://doi.org/10.1016/0097-8485(79)80002-9openalex-snapshot
Search for all self-avoiding paths for molecular graphs
inferredcites →https://doi.org/10.1016/0166-1280(84)80027-5openalex-snapshot
Chemical graph theory, vols. 1 and 2
inferredcites →https://doi.org/10.1016/b978-0-12-406560-4.x5001-6openalex-snapshot
Molecular Connectivity in Chemistry and Drug Research
inferredcites →https://doi.org/10.1016/s0021-9673(01)85209-2openalex-snapshot
The structural origin of chromatographic retention data
inferredcites →https://doi.org/10.1021/ar00141a002openalex-snapshot
New methods in computer-aided drug design
inferredcites →https://doi.org/10.1021/c160015a018openalex-snapshot
The Atom Connectivity Matrix (ACM) and Its Characteristic Polynomial (ACMCP).
inferredcites →https://doi.org/10.1021/ci00043a009openalex-snapshot
On molecular identification numbers
inferredcites →https://doi.org/10.1021/ci00046a002openalex-snapshot
Atom pairs as molecular features in structure-activity studies: definition and applications
inferredcites →https://doi.org/10.1021/ed069p519openalex-snapshot
The nature of the chemical bond—1992
inferredcites →https://doi.org/10.1021/ja00191a075openalex-snapshot
Graph theoretical approach to carbon-13 chemical shift sum in alkanes
inferredcites →https://doi.org/10.1021/ja00704a004openalex-snapshot
Semiempirical theory of diamagnetic susceptibilities with particular emphasis on oxygen-containing organic molecules
inferredcites →https://doi.org/10.1021/ja00814a007openalex-snapshot
Semiempirical magnetic susceptibilities of nitrogen-containing heterocycles
inferredcites →https://doi.org/10.1021/ja00856a001openalex-snapshot
Characterization of molecular branching
inferredcites →https://doi.org/10.1021/jm00222a020openalex-snapshot
Quantitative structure-activity relationships in centrally acting imidazolidines structurally related to clonidine
inferredcites →https://doi.org/10.1039/tf9534901375openalex-snapshot
Electron interaction in unsaturated hydrocarbons
inferredcites →https://doi.org/10.1063/1.1698929openalex-snapshot
A Semi-Empirical Theory of the Electronic Spectra and Electronic Structure of Complex Unsaturated Molecules. I.
inferredcites →https://doi.org/10.1246/bcsj.44.2332openalex-snapshot
Topological Index. A Newly Proposed Quantity Characterizing the Topological Nature of Structural Isomers of Saturated Hydrocarbons
What points at this work
Incoming claims: where this work appears in other papers’ reference lists and arguments.
inferred← citeshttps://doi.org/10.1002/qua.21702openalex-snapshot
Quantitative structure‐antibacterial activity relationship modeling using a combination of piecewise linear regression‐discriminant analysis (I): Quantum chemical, topographic, and topological descriptors
inferred← citeshttps://doi.org/10.1002/qua.560300718openalex-snapshot
On the identification numbers for chemical structures
inferred← citeshttps://doi.org/10.1002/qua.560440835openalex-snapshot
On the intercorrelation of topological indices in benzenoid hydrocarbons
inferred← citeshttps://doi.org/10.1006/jcis.1997.5104openalex-snapshot
A New Topological Index for Molecular Probes Used in Inverse Gas Chromatography for the Surface Nanorugosity Evaluation
inferred← citeshttps://doi.org/10.1007/0-306-46907-3_6openalex-snapshot
On Characterization of 3D Molecular Structure
inferred← citeshttps://doi.org/10.1007/bf01164840openalex-snapshot
In search of structural invariants
inferred← citeshttps://doi.org/10.1007/bf02937594openalex-snapshot
Anwendung der Hasse-Diagrammtechnik
inferred← citeshttps://doi.org/10.1007/bf03038746openalex-snapshot
Einsatz der Hasse-Diagrammtechnik zur vergleichenden Datenanalyse von Biomarkerantworten und ökotoxikologischen Tests
inferred← citeshttps://doi.org/10.1007/bf03038747openalex-snapshot
Demnächst erscheinender Beitrag: Einsatz der Hasse-Diagrammtechnik zur vergleichenden Bewertung von aquatischen Wirkungstests
inferred← citeshttps://doi.org/10.1007/s10910-007-9331-xopenalex-snapshot
Dominance and separability in posets, their application to isoelectronic species with equal total nuclear charge
inferred← citeshttps://doi.org/10.1007/s10953-011-9743-xopenalex-snapshot
Topological and Thermodynamic Studies for Binary Mixtures of 1,4-Dioxane with Anilines at 308.15 K
inferred← citeshttps://doi.org/10.1016/0043-1354(95)00065-sopenalex-snapshot
Advances in comparative analysis of adverse effects in aquatic ecosystems with emphasis on studies with humic substances and on progress in mathematical analysis techniques
inferred← citeshttps://doi.org/10.1016/0045-6535(94)90039-6openalex-snapshot
The technique of hasse diagrams applied on environmental online databanks
inferred← citeshttps://doi.org/10.1016/0045-6535(95)00018-4openalex-snapshot
Use of hasse diagram technique for evaluation of phospholipid fatty acids distribution as biomarkers in selected soils
inferred← citeshttps://doi.org/10.1016/0045-6535(95)00061-copenalex-snapshot
Applying Hasse diagram technique for the evaluation of toxicological fish tests
inferred← citeshttps://doi.org/10.1016/0045-6535(96)00274-3openalex-snapshot
Selection of priority properties to assess environmental hazard of pesticides
inferred← citeshttps://doi.org/10.1016/0166-1280(91)85053-aopenalex-snapshot
Correlation of enthalphy of octanes with orthogonal connectivity indices
inferred← citeshttps://doi.org/10.1016/0166-1280(91)85245-3openalex-snapshot
The algebraic modelling of chemical structures: On the development of three-dimensional molecular descriptors
inferred← citeshttps://doi.org/10.1016/0169-7439(91)80051-qopenalex-snapshot
Novel graph theoretical approach to heteroatoms in quantitative structure—activity relationships
inferred← citeshttps://doi.org/10.1016/s0097-8485(02)00053-0openalex-snapshot
Symmetry considerations in Markovian chemicals ‘in silico’ design (MARCH-INSIDE) I: central chirality codification, classification of ACE inhibitors and prediction of σ-receptor antagonist activities
inferred← citeshttps://doi.org/10.1016/s0097-8485(99)00060-1openalex-snapshot
A computer-based approach to describe the 13C NMR chemical shifts of alkanes by the generalized spectral moments of iterated line graphs
inferred← citeshttps://doi.org/10.1021/ci000170vopenalex-snapshot
Can 3D Structural Parameters Be Predicted from 2D (Topological) Molecular Descriptors?
inferred← citeshttps://doi.org/10.1021/ci025604wopenalex-snapshot
What Are the Limits of Applicability for Graph Theoretic Descriptors in QSPR/QSAR? Modeling Dipole Moments of Aromatic Compounds with TOPS-MODE Descriptors
inferred← citeshttps://doi.org/10.1021/ci950186zopenalex-snapshot
Edge Adjacency Relationships and Molecular Topographic Descriptors. Definition and QSAR Applications
inferred← citeshttps://doi.org/10.1021/ci970441aopenalex-snapshot
On the Characterization of Molecular Stereostructure: 1. Cis−Trans Isomerism
inferred← citeshttps://doi.org/10.1021/ci980034eopenalex-snapshot
On the Calculation of the Molecular Descriptor χ’/χ
inferred← citeshttps://doi.org/10.1021/ci9800460openalex-snapshot
Generalized Spectral Moments of the Iterated Line Graphs Sequence. A Novel Approach to QSPR Studies
inferred← citeshttps://doi.org/10.1021/ci9800559openalex-snapshot
A Theoretical Concept To Rank Environmentally Significant Chemicals
inferred← citeshttps://doi.org/10.1021/ci9900229openalex-snapshot
On the Relation between W ‘/W Index, Hyper-Wiener Index, and Wiener Number
inferred← citeshttps://doi.org/10.1023/a:1010931213729openalex-snapshot
Novel PI Indices of Hexagonal Chains
inferred← citeshttps://doi.org/10.1080/03067319608045565openalex-snapshot
Risk Assessment for Pesticides and Their Metabolites in Water
inferred← citeshttps://doi.org/10.1080/10629369808039158openalex-snapshot
Molecular Connectivity Indices of Iterated Line Graphs. A New Source of Descriptors for QSPR and QSAR Studies
inferred← citeshttps://doi.org/10.1201/b11590-2openalex-snapshot
Basic Concepts in Molecular Modeling
inferred← citeshttps://doi.org/10.17877/de290r-690openalex-snapshot
A practical overview of quantitative structure-activity relationship
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