On the public citation graph

Molecular Field Topology Analysis Method in QSAR Studies of Organic Compounds

0 signed · 92 inferred · view as graph

Inferred edges come from two machine sources: sweeps of open repository metadata (mostly SSRN and Zenodo), and a bulk OpenAlex citation snapshot. Every row below is labelled with the one it came from. Neither is a complete citation index — absence here is not evidence of absence.

Is this your work? Sign in with ORCID and put your name on the claims that are yours.
Claim with ORCID
Reference health. See whether every reference in this work resolves to a known work and none has been retracted — and get a dated CiteStamped badge you can embed.
See reference health

What this work says

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

inferredcites →https://doi.org/10.1002/9783527616824openalex-snapshot
QSAR: Hansch Analysis and Related Approaches
inferredcites →https://doi.org/10.1002/jcc.540090111openalex-snapshot
Atomic physicochemical parameters for three dimensional structure directed quantitative structure‐activity relationships III: Modeling hydrophobic interactions
inferredcites →https://doi.org/10.1002/jps.2600660303openalex-snapshot
Pattern Recognition II: Investigation of Structure-Activity Relationships
inferredcites →https://doi.org/10.1002/jps.2600660304openalex-snapshot
Pharmacokinetics of β-Methyldigoxin in Healthy Humans II: Oral Studies and Bioavailability
inferredcites →https://doi.org/10.1002/qsar.19900090304openalex-snapshot
A new Approach to Active‐Site Binding Analysis. Inhibitors of Acetylcholinesterase
inferredcites →https://doi.org/10.1002/qsar.19970160102openalex-snapshot
QSAR and Molecular Modelling of Catamphiphilic Drugs Able to Modulate Multidrug Resistance in Tumors
inferredcites →https://doi.org/10.1002/qsar.19970160104openalex-snapshot
Quantitative Structure‐Activity Relationship Studies on Some Acyclouridine Derivatives Acting as Anti‐HIV‐1 Drugs
inferredcites →https://doi.org/10.1016/0022-5193(77)90298-3openalex-snapshot
Mapping of dihydrofolate-reductase receptor site by correlation with minimal topological (steric) differences
inferredcites →https://doi.org/10.1016/0040-4020(80)80168-2openalex-snapshot
Iterative partial equalization of orbital electronegativity—a rapid access to atomic charges
inferredcites →https://doi.org/10.1016/0223-5234(91)90019-jopenalex-snapshot
QSAR: Rational approaches to the design of bioactive compounds
inferredcites →https://doi.org/10.1016/s0165-6147(00)89046-xopenalex-snapshot
QSAR: Hansch analysis and related approaches
inferredcites →https://doi.org/10.1021/ci00001a013openalex-snapshot
A comment on nomenclature and the unsaturated bond
inferredcites →https://doi.org/10.1021/ci00006a002openalex-snapshot
Generation of molecular graphs for QSAR studies: an approach based on acyclic fragment combinations
inferredcites →https://doi.org/10.1021/ci00006a003openalex-snapshot
ALF-A: a knowledge acquisition tool for troubleshooting of laboratory equipment
inferredcites →https://doi.org/10.1021/ci9704221openalex-snapshot
A Different Method for Steric Field Evaluation in CoMFA Improves Model Robustness
inferredcites →https://doi.org/10.1021/j100785a001openalex-snapshot
van der Waals Volumes and Radii
inferredcites →https://doi.org/10.1021/ja00134a023openalex-snapshot
Autocorrelation of Molecular Surface Properties for Modeling Corticosteroid Binding Globulin and Cytosolic Ah Receptor Activity by Neural Networks
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/ja00346a026openalex-snapshot
Electronegativity and bond energy
inferredcites →https://doi.org/10.1021/jm00092a004openalex-snapshot
Comparative molecular field analysis of anticoccidial triazines
inferredcites →https://doi.org/10.1021/jm00107a010openalex-snapshot
Modeling alcohol metabolism with the DARC/CALPHI system
inferredcites →https://doi.org/10.1021/jm00107a011openalex-snapshot
Specific bradycardic agents. 2. Heteroaromatic modifications in the side chain of specific bradycardic benzazepinones: chemistry, pharmacology, and structure-activity relationships
inferredcites →https://doi.org/10.1021/jm00334a002openalex-snapshot
The Metabolic Fate of Thiabendazole in Sheep1
inferredcites →https://doi.org/10.1021/jm950589qopenalex-snapshot
Comparative Molecular Moment Analysis (CoMMA): 3D-QSAR without Molecular Superposition
inferredcites →https://doi.org/10.1021/jm960291fopenalex-snapshot
Bioisosterism as a Molecular Diversity Descriptor: Steric Fields of Single “Topomeric” Conformers

What points at this work

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

inferred← citeshttps://doi.org/10.1002/9783527613106.biblioopenalex-snapshot
Bibliography
inferred← citeshttps://doi.org/10.1002/9783527628766.biblioopenalex-snapshot
Bibliography
inferred← citeshttps://doi.org/10.1002/chin.200034228openalex-snapshot
ChemInform Abstract: Molecular Field Topology Analysis Method in QSAR Studies of Organic Compounds.
inferred← citeshttps://doi.org/10.1002/jcc.26089openalex-snapshot
Smoothed Spherical Truncation based on Fuzzy Membership Functions: Application to the Molecular Encoding
inferred← citeshttps://doi.org/10.1002/minf.201000100openalex-snapshot
Chemoinformatics as a Theoretical Chemistry Discipline
inferred← citeshttps://doi.org/10.1002/minf.201800039openalex-snapshot
GOWAWA Aggregation Operator‐based Global Molecular Characterizations: Weighting Atom/bond Contributions (LOVIs/LOEIs) According to their Influence in the Molecular Encoding
inferred← citeshttps://doi.org/10.1002/poc.378openalex-snapshot
Novel point charge models: reliable instruments formolecular electrostatic
inferred← citeshttps://doi.org/10.1007/978-1-4939-7404-7_5openalex-snapshot
Molecular Field Topology Analysis (MFTA) in the Design of Neuroprotective Compounds
inferred← citeshttps://doi.org/10.1007/s00894-008-0293-0openalex-snapshot
Modeling the excitation wavelengths (λex) of boronic acids
inferred← citeshttps://doi.org/10.1007/s10822-006-9082-yopenalex-snapshot
GALAHAD: 1. Pharmacophore identification by hypermolecular alignment of ligands in 3D
inferred← citeshttps://doi.org/10.1007/s11030-021-10326-zopenalex-snapshot
Artificial intelligence and machine learning approaches for drug design: challenges and opportunities for the pharmaceutical industries
inferred← citeshttps://doi.org/10.1007/s11094-006-0145-0openalex-snapshot
Structure-biological activity relationship in prostaglandin analogs
inferred← citeshttps://doi.org/10.1007/s11172-016-1310-6openalex-snapshot
Online resources for the prediction of biological activity of organic compounds
inferred← citeshttps://doi.org/10.1007/s11172-016-1339-6openalex-snapshot
Molecular design of N,N-disubstituted 2-aminothiazolines as selective carboxylesterase inhibitors
inferred← citeshttps://doi.org/10.1007/s11172-025-4684-5openalex-snapshot
Empirical charge model taking into account the inductive effect to describe electrostatic interactions in compounds relevant to medicinal chemistry: assessment of applicability
inferred← citeshttps://doi.org/10.1007/s11434-006-2038-8openalex-snapshot
A novel comparative molecule/pseudo receptor interaction analysis
inferred← citeshttps://doi.org/10.1016/b978-0-12-816125-8.00013-4openalex-snapshot
Analysis of Chemical Spaces: Implications for Drug Repurposing
inferred← citeshttps://doi.org/10.1016/j.cbi.2012.10.012openalex-snapshot
Organophosphorus compound esterase profiles as predictors of therapeutic and toxic effects
inferred← citeshttps://doi.org/10.1016/j.chemolab.2006.10.002openalex-snapshot
Three dimensional holographic vector of atomic interaction field (3D-HoVAIF)
inferred← citeshttps://doi.org/10.1016/j.ejmech.2011.11.034openalex-snapshot
Computer-assisted rational design, synthesis, and bioassay of non-steroidal anti-inflammatory agents
inferred← citeshttps://doi.org/10.1016/j.ejmech.2014.04.018openalex-snapshot
Dual inhibition of the α-glucosidase and butyrylcholinesterase studied by Molecular Field Topology Analysis
inferred← citeshttps://doi.org/10.1016/j.ejmech.2026.119304openalex-snapshot
Exploring the role of conformational restriction in 5-alkyl-6-benzyl-2-{[(methylthio)methyl]thio}pyrimidin-4(3H)-ones: Effects in HIV-1 infected cells and reverse transcriptase enzymes
inferred← citeshttps://doi.org/10.1016/j.ipha.2024.11.003openalex-snapshot
Machine learning & deep learning tools in pharmaceutical sciences: A comprehensive review
inferred← citeshttps://doi.org/10.1016/j.jmgm.2010.03.005openalex-snapshot
Hybrid-genetic algorithm based descriptor optimization and QSAR models for predicting the biological activity of Tipranavir analogs for HIV protease inhibition
inferred← citeshttps://doi.org/10.1016/j.mencom.2010.09.001openalex-snapshot
Molecular modelling of central nervous system receptors
inferred← citeshttps://doi.org/10.1016/j.mencom.2017.11.029openalex-snapshot
Structural requirements for molecular design of positive allosteric modulators of AMPA receptor
inferred← citeshttps://doi.org/10.1016/s0065-3276(06)51004-4openalex-snapshot
Atomic Charges via Electronegativity Equalization: Generalizations and Perspectives
inferred← citeshttps://doi.org/10.1021/acsomega.6c08020openalex-snapshot
Systematic Structure–Activity Relationship Investigation on Novel 5-Alkyl-6-benzyl-2-{[(methylthio/phenylthio)alkyl]thio}-pyrimidin-4(3 H )-ones Endowed with Potent Anti-HIV-1 Activity
inferred← citeshttps://doi.org/10.1021/ci010124aopenalex-snapshot
MTD-PLS: A PLS-Based Variant of the MTD Method. 2. Mapping Ligand−Receptor Interactions. Enzymatic Acetic Acid Esters Hydrolysis
inferred← citeshttps://doi.org/10.1021/ci0103830openalex-snapshot
Evaluation of a Novel Electronic Eigenvalue (EEVA) Molecular Descriptor for QSAR/QSPR Studies: Validation Using a Benchmark Steroid Data Set
inferred← citeshttps://doi.org/10.1021/ci0103875openalex-snapshot
Generation and Display of Activity-Weighted Chemical Hyperstructures
inferred← citeshttps://doi.org/10.1021/ci034027oopenalex-snapshot
FLUFF-BALL, A Template-Based Grid-Independent Superposition and QSAR Technique: Validation Using a Benchmark Steroid Data Set
inferred← citeshttps://doi.org/10.1021/ci400723mopenalex-snapshot
Synthesis, Bioassay, and Molecular Field Topology Analysis of Diverse Vasodilatory Heterocycles
inferred← citeshttps://doi.org/10.1021/jm0602559openalex-snapshot
Nonpeptide Inhibitors of Measles Virus Entry
inferred← citeshttps://doi.org/10.1021/jm070679iopenalex-snapshot
Discovery of Small Molecule CXCR4 Antagonists
inferred← citeshttps://doi.org/10.1021/jm701239aopenalex-snapshot
Potent Non-Nucleoside Inhibitors of the Measles Virus RNA-Dependent RNA Polymerase Complex
inferred← citeshttps://doi.org/10.1021/jm701442dopenalex-snapshot
Probing Distal Regions of the A2B Adenosine Receptor by Quantitative Structure−Activity Relationship Modeling of Known and Novel Agonists
inferred← citeshttps://doi.org/10.1023/b:jcam.0000035198.11110.48openalex-snapshot
Ligand intramolecular motions in ligand-protein interaction: ALPHA, a novel dynamic descriptor and a QSAR study with extended steroid benchmark dataset
inferred← citeshttps://doi.org/10.1039/9781782623731-00120openalex-snapshot
Chemical Similarity, Shape Matching and QSAR
inferred← citeshttps://doi.org/10.1039/9781847558879-00150openalex-snapshot
Molecular Field Topology Analysis in Drug Design and Virtual Screening
inferred← citeshttps://doi.org/10.1080/10629360108035372openalex-snapshot
MTD-PLS: A PLS-Based Variant of the MTD Method. A 3D-QSAR Analysis of Receptor Affinities for a Series of Halogenated Dibenzoxin and Biphenyl Derivatives
inferred← citeshttps://doi.org/10.1080/1062936x.2012.679690openalex-snapshot
Combined QSAR studies of inhibitor properties ofO-phosphorylated oximes toward serine esterases involved in neurotoxicity, drug metabolism and Alzheimer's disease
inferred← citeshttps://doi.org/10.1080/1062936x.2018.1513218openalex-snapshot
2D and 3D structure–activity modelling of mosquito repellents: a review $
inferred← citeshttps://doi.org/10.1080/10659360500468419openalex-snapshot
Improving the performance of SOMFA by use of standard multivariate methods
inferred← citeshttps://doi.org/10.1109/idaacs.2003.1249590openalex-snapshot
Virtual computational chemistry laboratory: internet tool for remote modeling and design in chemical problems
inferred← citeshttps://doi.org/10.1134/s0012500807080058openalex-snapshot
Generation of chemical structures on the basis of QSAR models of molecular field topology analysis
inferred← citeshttps://doi.org/10.1134/s0012500808090073openalex-snapshot
Computer-aided design of selective ligands of the benzodiazepine-binding site of the GABAA receptor
inferred← citeshttps://doi.org/10.1134/s0012500812040027openalex-snapshot
Computer-aided design of arylphthalazines as potential smoothened receptor antagonists
inferred← citeshttps://doi.org/10.1134/s1019331610030147openalex-snapshot
Medical chemistry for brain function correction
inferred← citeshttps://doi.org/10.1134/s1607672908010122openalex-snapshot
Modeling of the relationships between the structure of O-phosphorylated oximes and their anticholinesterase activity and selectivity using molecular field topology analysis (MFTA)
inferred← citeshttps://doi.org/10.1134/s1607672909060064openalex-snapshot
Study of the structural determinants of acute and delayed neurotoxicity of O-phosphorylated oximes by molecular field topology analysis (MFTA)
inferred← citeshttps://doi.org/10.1134/s1607672912020093openalex-snapshot
Molecular design of O-phosphorylated oximes—Selective inhibitors of butyrylcholinesterase
inferred← citeshttps://doi.org/10.1134/s1607672912020159openalex-snapshot
Computer-aided modeling of activity and selectivity of quinazolinones as noncompetitive NMDA receptor antagonists
inferred← citeshttps://doi.org/10.1134/s1607672915020167openalex-snapshot
Molecular design of selective ligands of chemokine receptors
inferred← citeshttps://doi.org/10.1186/1752-153x-2-s1-p8openalex-snapshot
Molecular field topology analysis and structure generation
inferred← citeshttps://doi.org/10.1186/1752-153x-3-s1-p23openalex-snapshot
Modelling the multi-target selectivity: o-phosphorylated oximes as serine hydrolase inhibitors
inferred← citeshttps://doi.org/10.1186/1758-2946-2-s1-p49openalex-snapshot
Ionotropic GABA receptors: modelling and design of selective ligands
inferred← citeshttps://doi.org/10.1186/s13321-018-0306-7openalex-snapshot
Choquet integral-based fuzzy molecular characterizations: when global definitions are computed from the dependency among atom/bond contributions (LOVIs/LOEIs)
inferred← citeshttps://doi.org/10.1360/csb2006-51-12-1390openalex-snapshot
一种新的比较分子/虚拟受体相互作用分析法
inferred← citeshttps://doi.org/10.1371/annotation/1dc83f26-8045-4b63-8a86-24c7b71a7f79openalex-snapshot
Correction: Promising Aedes aegypti Repellent Chemotypes Identified through Integrated QSAR, Virtual Screening, Synthesis, and Bioassay
inferred← citeshttps://doi.org/10.1371/journal.pone.0064547openalex-snapshot
Promising Aedes aegypti Repellent Chemotypes Identified through Integrated QSAR, Virtual Screening, Synthesis, and Bioassay
inferred← citeshttps://doi.org/10.1517/17460441.2015.1060216openalex-snapshot
Progress in visual representations of chemical space
inferred← citeshttps://doi.org/10.18520/cs/v114/i10/2063-2071openalex-snapshot
Quantitative Structure–Activity Relationship and Combinatorial Design of 1,3,4-Oxadiazole-Based Thymidine Phosphorylase Inhibitors as Potential Anti-Cancer Agents
inferred← citeshttps://doi.org/10.2174/156802609789753581openalex-snapshot
Cancer and Virus Leads by HTS, Chemical Design and SEA Data Mining
inferred← citeshttps://doi.org/10.2174/1568026619666190123160406openalex-snapshot
Prediction of Drug-Drug Interactions Related to Inhibition or Induction of Drug-Metabolizing Enzymes
inferred← citeshttps://doi.org/10.2174/9789815223019124010007openalex-snapshot
Virtual Tools and Screening Designs for Drug Discovery and New Drug Development
inferred← citeshttps://doi.org/10.3109/10520295.2013.785593openalex-snapshot
Development of a quantitative structure activity relations (QSAR) model to guide the design of fluorescent dyes for detecting amyloid fibrils
Editorial review for independent work. ICSAC — the Institute for Complexity Science and Advanced Computing — runs a structured editorial panel for researchers publishing outside journals, and publishes on CiteStamp rails. Submission is free and goes through ORCID: icsacinstitute.org/submit.