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Modeling Antileukemic Activity of Carboquinones with Electrotopological State and Chi Indices

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What this work says

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

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Reviews in Computational Chemistry
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ChemInform Abstract: Binding of Salicylamides: QSAR Analysis with Electrotopological State Indexes.
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ESTIMATION OF ENVIRONMENTAL AND TOXICOLOGICAL PROPERTIES: APPROACH AND METHODOLOGY
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STRUCTURE-ACTIVITY RELATIONSHIP STUDIES ON THE TOXICITY OF BENZENE DERIVATIVES: III. PREDICTIONS AND EXTENSION TO NEW SUBSTITUENTS
inferredcites →https://doi.org/10.1002/etc.5620080905openalex-snapshot
QSAR INVESTIGATION OF BENZENE TOXICITY TO FATHEAD MINNOW USING MOLECULAR CONNECTIVITY
inferredcites →https://doi.org/10.1002/etc.5620120721openalex-snapshot
QUANTITATIVE STRUCTURE-ACTIVITY RELATIONSHIPS FOR PREDICTING THE TOXICITY OF PESTICIDES IN AQUATIC SYSTEMS WITH SEDIMENT
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Molecular Connectivity in Structure–activity Analysis
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Multivariate quantitative structure‐activity relationship (QSAR) methods which may be applied to pesticide research
inferredcites →https://doi.org/10.1002/qsar.19910100108openalex-snapshot
The Electrotopological State: An Atom Index for QSAR
inferredcites →https://doi.org/10.1002/qsar.19930120107openalex-snapshot
Comparison of Electrotopological State Indexes with Molecular Orbital Parameters: Inhibition of MAO by Hydrazides
inferredcites →https://doi.org/10.1007/bf01200825openalex-snapshot
An index of electrotopological state for atoms in molecules
inferredcites →https://doi.org/10.1016/0048-9697(91)90213-xopenalex-snapshot
QSARs for toxicity of organophosphorous pesticides to Daphnia and honeybees
inferredcites →https://doi.org/10.1016/0960-894x(96)00418-0openalex-snapshot
New cytostatic agents obtained by molecular topology
inferredcites →https://doi.org/10.1016/b978-0-12-013322-2.50005-xopenalex-snapshot
Atom Description in QSAR Models: Development and Use of an Atom Level Index
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/ci00025a018openalex-snapshot
Structure-Activity Study on Antiulcer Agents Using Wiener's Topological Index and Molecular Connectivity Index
inferredcites →https://doi.org/10.1021/ci00028a014openalex-snapshot
Electrotopological State Indices for Atom Types: A Novel Combination of Electronic, Topological, and Valence State Information
inferredcites →https://doi.org/10.1021/jm00191a006openalex-snapshot
Quantitative structure-activity relationships in 2,5-bis(1-aziridinyl)-p-benzoquinone derivatives against leukemia L-1210
inferredcites →https://doi.org/10.1021/jm00191a007openalex-snapshot
Alkylating nucleosides. 1. Synthesis and cytostatic activity of N-glycosyl(halomethyl)-1,2,3-triazoles. A new type of alkylating agent
inferredcites →https://doi.org/10.1023/a:1008048822117openalex-snapshot
QSAR modeling with the electrotopological state indices: Corticosteroids
inferredcites →https://doi.org/10.1023/a:1015952613760openalex-snapshot
An Electrotopological-State Index for Atoms in Molecules
inferredcites →https://doi.org/10.1139/f83-096openalex-snapshot
Structure–Toxicity Relationships for the Fathead Minnow, Pimephales promelas: Narcotic Industrial Chemicals

What points at this work

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

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History of Quantitative Structure‐Activity Relationships
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History of Quantitative Structure–Activity Relationships
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Bibliography
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Bibliography
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Prediction of Phosphoglycoprotein (P‐gp)‐Mediated Disposition in Early Drug Discovery
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A Structure‐Information Approach to the Prediction of Biological Activities and Properties
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Modeling Dipeptides as ACE Inhibitors and Bitter‐Tasting Compounds by Means of E‐State Structure‐Information Representation
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Application of Molecular Connectivity and Electro‐Topological Indices in Quantitative Structure–Activity Analysis of Pyrazole Derivatives as Inhibitors of Factor Xa and Thrombin
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Prediction of Tyrosinase Inhibition Activity Using Atom‐Based Bilinear Indices
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Quantitative structure/property relationship analysis of Caco‐2 permeability using a genetic algorithm‐based partial least squares method
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Predicting P-glycoprotein substrates by a quantitative structure–activity relationship model
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Topological Quantitative Structure–Activity Relationship Applications: Structure Information Representation in Drug Discovery
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Predicting antitrichomonal activity: A computational screening using atom-based bilinear indices and experimental proofs
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QSAR modeling of the MAO inhibitory activity of xanthones derivatives
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Ecotoxicological QSAR modeling of the acute toxicity of organic compounds to the freshwater crustacean Thamnocephalus platyurus
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Atom-based stochastic and non-stochastic 3D-chiral bilinear indices and their applications to central chirality codification
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Improved in silico prediction of carcinogenic potency (TD50) and the risk specific dose (RSD) adjusted Threshold of Toxicological Concern (TTC) for genotoxic chemicals and pharmaceutical impurities
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The E-state in database analysis: the PCBs as an example
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Predicting the carcinogenic potential of pharmaceuticals in rodents using molecular structural similarity and E-state indices
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A topological study of prodrugs of 5-fluorouracil
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E-State Modeling of Dopamine Transporter Binding. Validation of the Model for a Small Data Set
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QSAR Modeling with the Electrotopological State: TIBO Derivatives
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E-State Modeling of Corticosteroids Binding AffinityValidation of Model for Small Data Set
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E-State Modeling of HIV-1 Protease Inhibitor Binding Independent of 3D Information
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Modeling Blood-Brain Barrier Partitioning Using the Electrotopological State
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Modeling Drug Albumin Binding Affinity with E-State Topological Structure Representation
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Bounds for the Randić Connectivity Index
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Neural Network Modeling for Estimation of Partition Coefficient Based on Atom-Type Electrotopological State Indices
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Quantitative Structure−Activity (Affinity) Relationship (QSAR) Study on Protonation and Cationization of α-Amino Acids
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Fast Computation of Cross-Validated Properties in Full Linear Leave-Many-Out Procedures
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QSAR modeling of β-lactam binding to human serum proteins
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Molecular Descriptors for Database Mining. Translating Empirical Chemistry into Mathematics: Tools for QSAR and In Silico Screening Based on the Hydrophobicity of Small Molecules
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E-State Modeling of Fish Toxicity Independent of 3D Structure Information
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A descriptor-based analysis to highlight the mechanistic rationale of mutagenicity
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Comparison of Quantitative Structure-Activity Relationship Model Performances on Carboquinone Derivatives
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QSRR Study for Gas and Liquid Chromatographic Retention Indices of Polyhalogenated Biphenyls Using Two 2D Descriptors
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CYCLICITY ANALYSIS OF AMINO-ACIDS ON TYPE I COLLAGEN CHAINS
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2D QSAR Analysis of Substituted Quinoxalines for their Antitubercular and Antileptospiral Activities
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Review of QSAR Models and Software Tools for predicting Acute and Chronic Systemic Toxicity
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Topological, hydrophobicity, and other descriptors on α-glucosidase inhibition: a QSAR study on xanthone derivatives
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