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Novel ZE-Isomerism Descriptors Derived from Molecular Topology and Their Application to QSAR Analysis

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Outgoing claims: the papers this work cites, builds on, or argues with.

inferredcites →https://doi.org/10.1002/9783527613106openalex-snapshot
Handbook of Molecular Descriptors
inferredcites →https://doi.org/10.1002/j.1538-7305.1948.tb00917.xopenalex-snapshot
A Mathematical Theory of Communication
inferredcites →https://doi.org/10.1002/j.1538-7305.1948.tb01338.xopenalex-snapshot
A Mathematical Theory of Communication
inferredcites →https://doi.org/10.1002/jcc.540020202openalex-snapshot
Isomer discrimination by topological information approach
inferredcites →https://doi.org/10.1002/jps.2600760325openalex-snapshot
Molecular Connectivity in Structure–activity Analysis
inferredcites →https://doi.org/10.1002/qsar.19850040303openalex-snapshot
A Shape Index from Molecular Graphs
inferredcites →https://doi.org/10.1002/qsar.19850040304openalex-snapshot
A Method for Determining the Theoretical Carcinogenicity of Polycyclic Aromatic Hydrocarbons
inferredcites →https://doi.org/10.1002/qsar.19870060103openalex-snapshot
Inclusion of Symmetry as a Shape Attribute in Kappa Index Analysis
inferredcites →https://doi.org/10.1002/qsar.19870060104openalex-snapshot
Hydrophobic Properties of Chromones and Flavones. Relationships Between Octanol/Water Partition Coefficients and RP‐HPLC Capacity Factors
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/qsar.19910100108openalex-snapshot
The Electrotopological State: An Atom Index for QSAR
inferredcites →https://doi.org/10.1002/qsar.19910100208openalex-snapshot
A Differential Molecular Connectivity Index
inferredcites →https://doi.org/10.1007/bf00134175openalex-snapshot
E-state fields: Applications to 3D QSAR
inferredcites →https://doi.org/10.1016/0165-6147(88)90012-0openalex-snapshot
Three-dimensional structure-activity relationships
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/s1093-3263(01)00101-2openalex-snapshot
Overall connectivity — a next generation molecular connectivity
inferredcites →https://doi.org/10.1016/s1093-3263(01)00123-1openalex-snapshot
Beware of q2!
inferredcites →https://doi.org/10.1016/s1093-3263(98)00013-8openalex-snapshot
Prediction of properties of chiral compounds by molecular topology
inferredcites →https://doi.org/10.1016/s1367-5931(98)80012-4openalex-snapshot
Computational methods in molecular diversity and combinatorial chemistry
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/ci00001a013openalex-snapshot
A comment on nomenclature and the unsaturated bond
inferredcites →https://doi.org/10.1021/ci000082aopenalex-snapshot
Novel Chirality Descriptors Derived from Molecular Topology
inferredcites →https://doi.org/10.1021/ci00008a012openalex-snapshot
Applications of the radius-diameter diagram to the classification of topological and geometrical shapes of chemical compounds
inferredcites →https://doi.org/10.1021/ci000115mopenalex-snapshot
Graph Theoretical Descriptors of Two-Dimensional Chirality with Possible Extension to Three-Dimensional Chirality
inferredcites →https://doi.org/10.1021/ci00015a005openalex-snapshot
Counts of all walks as atomic and molecular descriptors
inferredcites →https://doi.org/10.1021/ci00027a011openalex-snapshot
Topological Organic Chemistry. 9. Graph Theory and Molecular Topological Indices of Stereoisomeric Organic Compounds
inferredcites →https://doi.org/10.1021/ci025516bopenalex-snapshot
QSAR Modeling Using Chirality Descriptors Derived from Molecular Topology
inferredcites →https://doi.org/10.1021/ci960014hopenalex-snapshot
Palindromic Perimeter Codes and Chirality Properties of Polyhexes
inferredcites →https://doi.org/10.1021/ci960174topenalex-snapshot
On Characterization of Chemical Structure
inferredcites →https://doi.org/10.1021/ci970095xopenalex-snapshot
Rational Combinatorial Library Design. 1. Focus-2D: A New Approach to the Design of Targeted Combinatorial Chemical Libraries
inferredcites →https://doi.org/10.1021/ci970441aopenalex-snapshot
On the Characterization of Molecular Stereostructure: 1. Cis−Trans Isomerism
inferredcites →https://doi.org/10.1021/ci980033mopenalex-snapshot
Novel Variable Selection Quantitative Structure−Property Relationship Approach Based on the k -Nearest-Neighbor Principle
inferredcites →https://doi.org/10.1021/ci980103popenalex-snapshot
Rational Combinatorial Library Design. 3. Simulated Annealing Guided Evaluation (SAGE) of Molecular Diversity: A Novel Computational Tool for Universal Library Design and Database Mining
inferredcites →https://doi.org/10.1021/ci990120uopenalex-snapshot
Overall Connectivities/Topological Complexities: A New Powerful Tool for QSPR/QSAR
inferredcites →https://doi.org/10.1021/j150495a009openalex-snapshot
Prediction of Isomeric Differences in Paraffin Properties
inferredcites →https://doi.org/10.1021/ja00226a005openalex-snapshot
Comparative molecular field analysis (CoMFA). 1. Effect of shape on binding of steroids to carrier proteins
inferredcites →https://doi.org/10.1021/ja00856a001openalex-snapshot
Characterization of molecular branching
inferredcites →https://doi.org/10.1021/ja00856a002openalex-snapshot
Importance of nonbonded attraction in the stereochemistry of the SN2' reaction
inferredcites →https://doi.org/10.1021/ja01193a005openalex-snapshot
Structural Determination of Paraffin Boiling Points
inferredcites →https://doi.org/10.1021/jm00007a003openalex-snapshot
Cross-Validated R2-Guided Region Selection for Comparative Molecular Field Analysis: A Simple Method To Achieve Consistent Results
inferredcites →https://doi.org/10.1021/jm00090a021openalex-snapshot
Synthesis and evaluation of analogs of (Z)-1-(4-methoxyphenyl)-2-(3,4,5-trimethoxyphenyl)ethene as potential cytotoxic and antimitotic agents
inferredcites →https://doi.org/10.1021/jm00090a022openalex-snapshot
2-Acetylpyridine thiocarbonohydrazones. Potent inactivators of herpes simplex virus ribonucleotide reductase
inferredcites →https://doi.org/10.1021/jm00112a036openalex-snapshot
Synthesis and evaluation of stilbene and dihydrostilbene derivatives as potential anticancer agents that inhibit tubulin polymerization
inferredcites →https://doi.org/10.1021/jm00112a037openalex-snapshot
Relaxant activity of 6-cyano-2,2-dimethyl-2H-1-benzopyran-4-carboxamides and -thiocarboxamides and their analogs in guinea pig trachealis
inferredcites →https://doi.org/10.1021/jm950447wopenalex-snapshot
Comparative Molecular Field Analysis-Based Prediction of Drug Affinities at Recombinant D1A Dopamine Receptors
inferredcites →https://doi.org/10.1021/jm950771ropenalex-snapshot
Structure-Based Alignment and Comparative Molecular Field Analysis of Acetylcholinesterase Inhibitors
inferredcites →https://doi.org/10.1021/jm980415jopenalex-snapshot
Quantitative Structure−Activity Relationship Modeling of Dopamine D1Antagonists Using Comparative Molecular Field Analysis, Genetic Algorithms−Partial Least-Squares, and K Nearest Neighbor Methods
inferredcites →https://doi.org/10.1063/1.430994openalex-snapshot
Graph theory and molecular orbitals. XII. Acyclic polyenes
inferredcites →https://doi.org/10.1080/00401706.1985.10488024openalex-snapshot
Applied Statistics: A Handbook of Techniques
inferredcites →https://doi.org/10.1080/10629360108035379openalex-snapshot
Overall Molecular Descriptors. 3. Overall Zagreb Indices
inferredcites →https://doi.org/10.1080/10629369708039123openalex-snapshot
Novel Indices for the Topological Complexity of Molecules
inferredcites →https://doi.org/10.2174/1381612013397834openalex-snapshot
Identification of the Descriptor Pharmacophores Using Variable Selection QSAR Applications to Database Mining

What points at this work

Incoming claims: where this work appears in other papers’ reference lists and arguments.

inferred← citeshttps://doi.org/10.1002/9783527628766.biblioopenalex-snapshot
Bibliography
inferred← citeshttps://doi.org/10.1002/cbdv.200490010openalex-snapshot
A Structure‐Information Approach to the Prediction of Biological Activities and Properties
inferred← citeshttps://doi.org/10.1002/chin.200239222openalex-snapshot
Novel ZE‐Isomerism Descriptors Derived from Molecular Topology and Their Application to QSAR Analysis.
inferred← citeshttps://doi.org/10.1002/chin.200444298openalex-snapshot
Whole Molecule and Atom‐Based Topological Descriptors
inferred← citeshttps://doi.org/10.1002/jssc.200700152openalex-snapshot
Structure–retention relationship study of diastereomeric (Z)‐ and (E)‐2‐alkylidene‐4‐oxothiazolidines
inferred← citeshttps://doi.org/10.1002/qsar.200730048openalex-snapshot
Description and Application of Similarity‐Based Methods for Fast and Simple QSAR Model Development
inferred← citeshttps://doi.org/10.1002/qua.27112openalex-snapshot
A study of two‐dimensional coronene fractal structures with M‐polynomials
inferred← citeshttps://doi.org/10.1007/978-0-387-30440-3_422openalex-snapshot
QSAR Modeling and QSAR Based Virtual Screening, Complexity and Challenges of Modern
inferred← citeshttps://doi.org/10.1007/978-3-319-27282-5_37openalex-snapshot
Predictive QSAR Modeling: Methods and Applications in Drug Discovery and Chemical Risk Assessment
inferred← citeshttps://doi.org/10.1007/978-94-007-0711-5_37openalex-snapshot
Predictive QSAR Modeling: Methods and Applications in Drug Discovery and Chemical Risk Assessment
inferred← citeshttps://doi.org/10.1007/978-94-007-6169-8_37-2openalex-snapshot
Predictive QSAR Modeling: Methods and Applications in Drug Discovery and Chemical Risk Assessment
inferred← citeshttps://doi.org/10.1007/978-94-007-6169-8_37-3openalex-snapshot
Predictive QSAR Modeling: Methods and Applications in Drug Discovery and Chemical Risk Assessment
inferred← citeshttps://doi.org/10.1007/s00044-012-0361-yopenalex-snapshot
Selection of nutraceutical compounds as COX inhibitors by molecular topology
inferred← citeshttps://doi.org/10.1007/s10910-021-01321-8openalex-snapshot
Graph entropies, enumeration of circuits, walks and topological properties of three classes of isoreticular metal organic frameworks
inferred← citeshttps://doi.org/10.1007/s10910-023-01477-5openalex-snapshot
Covalent organic frameworks: topological characterizations, spectral patterns and graph entropies
inferred← citeshttps://doi.org/10.1007/s11009-021-09895-1openalex-snapshot
Several Topological Indices of Random Caterpillars
inferred← citeshttps://doi.org/10.1007/s11030-005-9007-zopenalex-snapshot
True prediction of lowest observed adverse effect levels
inferred← citeshttps://doi.org/10.1007/s11696-024-03743-5openalex-snapshot
Degree-based topological insights and graph entropies of Kagome lattice covalent organic frameworks
inferred← citeshttps://doi.org/10.1016/b0-08-045044-x/00248-0openalex-snapshot
Predictive Quantitative Structure–Activity Relationship Modeling
inferred← citeshttps://doi.org/10.1016/j.asej.2024.102868openalex-snapshot
On the modeling and computation of molecular descriptors of a novel next-generation wonder material γ-graphyne and zig-zag Gamma graphyne nanoribbon
inferred← citeshttps://doi.org/10.1016/j.bmc.2004.09.003openalex-snapshot
Quantitative structure–activity relationship study using refractotopological state atom index on some neonicotinoid insecticides
inferred← citeshttps://doi.org/10.1016/j.bmc.2006.10.032openalex-snapshot
QSAR study of anticoccidial activity for diverse chemical compounds: Prediction and experimental assay of trans-2-(2-nitrovinyl)furan
inferred← citeshttps://doi.org/10.1016/j.cplett.2008.05.009openalex-snapshot
Estimating the Zagreb indices and the spectral radius of triangle- and quadrangle-free connected graphs
inferred← citeshttps://doi.org/10.1016/j.jphotochem.2026.117526openalex-snapshot
Potential applications of artificial intelligence in photocatalysis performance enhancement: a review
inferred← citeshttps://doi.org/10.1021/ci034119dopenalex-snapshot
QSAR Study of Catalytic Asymmetric Reactions with Topological Indices
inferred← citeshttps://doi.org/10.1021/ci0600511openalex-snapshot
A Steroids QSAR Approach Based on Approximate Similarity Measurements
inferred← citeshttps://doi.org/10.1021/ci2006092openalex-snapshot
Modeling Drug-Induced Anorexia by Molecular Topology
inferred← citeshttps://doi.org/10.1021/ci600216hopenalex-snapshot
Refinement and Use of the Approximate Similarity in QSAR Models for Benzodiazepine Receptor Ligands
inferred← citeshttps://doi.org/10.1021/jm050260xopenalex-snapshot
Development of Quantitative Structure−Binding Affinity Relationship Models Based on Novel Geometrical Chemical Descriptors of the Protein−Ligand Interfaces
inferred← citeshttps://doi.org/10.1023/b:modi.0000047504.14261.2aopenalex-snapshot
On reformulated Zagreb indices
inferred← citeshttps://doi.org/10.1038/s41598-024-79168-7openalex-snapshot
Characterization of entropy measures with connection number based indices of boric acid hydrogen-bonded 2D lattice sheets
inferred← citeshttps://doi.org/10.1038/s41598-025-01210-zopenalex-snapshot
Topological information entropy and spectral energy analysis in aminal-linked covalent organic frameworks
inferred← citeshttps://doi.org/10.1038/s41598-025-11863-5openalex-snapshot
Topological modeling and QSPR based prediction of physicochemical properties of bioactive polyphenols
inferred← citeshttps://doi.org/10.1039/b926047aopenalex-snapshot
Application of molecular topology for the prediction of the reaction times and yields under solvent-free conditions
inferred← citeshttps://doi.org/10.1080/00268976.2022.2079568openalex-snapshot
Two-dimensional coronene fractal structures: topological entropy measures, energetics, NMR and ESR spectroscopic patterns and existence of isentropic structures
inferred← citeshttps://doi.org/10.1080/00268976.2023.2211403openalex-snapshot
Computation of some important degree-based topological indices for γ- graphyne and Zigzag graphyne nanoribbon
inferred← citeshttps://doi.org/10.1080/00268976.2023.2212533openalex-snapshot
Reverse-degree-based topological indices of fullerene cage networks
inferred← citeshttps://doi.org/10.1080/10406638.2021.1923537openalex-snapshot
On Computations of Topological Descriptors of Kagome Lattice
inferred← citeshttps://doi.org/10.1080/10406638.2023.2273883openalex-snapshot
On Degree-Based Topological Indices of Kagome Graphene, and Carbon Kagome Nanotubes and Nanotori
inferred← citeshttps://doi.org/10.1080/10629360412331319844openalex-snapshot
QSAR Modeling of Datasets with Enantioselective Compounds using Chirality Sensitive Molecular Descriptors
inferred← citeshttps://doi.org/10.1080/10629360412331319853openalex-snapshot
QSAR Modeling Based on Structure-Information for Properties of Interest in Human Health
inferred← citeshttps://doi.org/10.1080/1062936x.2014.919959openalex-snapshot
Structure–activity relationship study of trifluoromethylketone inhibitors of insect juvenile hormone esterase: Comparison of several classification methods
inferred← citeshttps://doi.org/10.1080/10659360500036927openalex-snapshot
Predictability and prediction of lowest observed adverse effect levels in a structurally heterogeneous set of chemicals
inferred← citeshttps://doi.org/10.1088/1402-4896/ad10dbopenalex-snapshot
Reverse-degree-based topological indices of two-dimensional coronene fractal structures
inferred← citeshttps://doi.org/10.1103/physreve.109.024314openalex-snapshot
Complex networks with complex weights
inferred← citeshttps://doi.org/10.1140/epjp/s13360-022-02513-0openalex-snapshot
Degree-based topological indices of geranyl and farnesyl penicillin G bioconjugate structure
inferred← citeshttps://doi.org/10.1155/2013/798508openalex-snapshot
Predicting Dyspnea Inducers by Molecular Topology
inferred← citeshttps://doi.org/10.1155/2020/8819008openalex-snapshot
On Topological Descriptors of Certain Metal-Organic Frameworks
inferred← citeshttps://doi.org/10.1155/2021/6614840openalex-snapshot
Topological Indices of Derived Networks of Benzene Ring Embedded in P -Type Surface on 2 D
inferred← citeshttps://doi.org/10.1155/2021/6690053openalex-snapshot
On Topological Indices for New Classes of Benes Network
inferred← citeshttps://doi.org/10.1155/2022/5426037openalex-snapshot
Topological Aspects of Certain Covalent Organic Frameworks and Metal Organic Frameworks
inferred← citeshttps://doi.org/10.1201/9780203642627.ch5openalex-snapshot
Whole Molecule and Atom-Based Topological Descriptors
inferred← citeshttps://doi.org/10.1201/b18389-3openalex-snapshot
The Adjacency Matrix and Related Matrices
inferred← citeshttps://doi.org/10.1504/ijcbdd.2014.066540openalex-snapshot
Detour matrix-based adjacent path eccentric distance sum indices for QSAR/QSPR. Part I: development and evaluation
inferred← citeshttps://doi.org/10.1515/zna-2017-0135openalex-snapshot
On Certain Topological Indices of Boron Triangular Nanotubes
inferred← citeshttps://doi.org/10.1517/17460441.2013.748745openalex-snapshot
Advances in the molecular modeling and quantitative structure–activity relationship-based design for antihistamines
inferred← citeshttps://doi.org/10.2174/156802607780906771openalex-snapshot
Medicinal Chemistry and Bioinformatics - Current Trends in Drugs Discovery with Networks Topological Indices
inferred← citeshttps://doi.org/10.3390/axioms15040291openalex-snapshot
Zagreb-Type Indices of the Fractal Graphs Based on Star Graphs
inferred← citeshttps://doi.org/10.3390/i8200456openalex-snapshot
Internal Test Sets Studies in a Group of Antimalarials
inferred← citeshttps://doi.org/10.3390/ijms12021281openalex-snapshot
Application of Molecular Topology for the Prediction of Reaction Yields and Anti-Inflammatory Activity of Heterocyclic Amidine Derivatives
inferred← citeshttps://doi.org/10.3797/scipharm.0804-12openalex-snapshot
Chemical Structure Indices in In Silico Molecular Design
inferred← citeshttps://doi.org/10.4018/978-1-60960-818-7.ch517openalex-snapshot
Application of Machine Leaning in Drug Discovery and Development
inferred← citeshttps://doi.org/10.4018/978-1-61520-911-8.ch012openalex-snapshot
Application of Machine Leaning in Drug Discovery and Development
inferred← citeshttps://doi.org/10.4067/s0717-97072012000100001openalex-snapshot
AN IMPROVED TOPOLOGICAL DESCRIPTOR EDm AND ITS APPLICATION
inferred← citeshttps://doi.org/10.5012/bkcs.2011.32.7.2397openalex-snapshot
Development of kNN QSAR Models for 3-Arylisoquinoline Antitumor Agents
inferred← citeshttps://doi.org/10.5668/jehs.2015.41.2.90openalex-snapshot
Assessment through Statistical Methods of Water Quality Parameters(WQPs) in the Han River in Korea
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