On the public citation graph
Novel Atomic-Level-Based AI Topological Descriptors: Application to QSPR/QSAR Modeling
0 signed · 44 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.
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known work and none has been retracted — and get a dated CiteStamped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.
What this work says
Outgoing claims: the papers this work cites, builds on, or argues with.
inferredcites →https://doi.org/10.1007/bf01169597openalex-snapshot
On the three-dimensional wiener number
inferredcites →https://doi.org/10.1016/0009-2614(82)80009-2openalex-snapshot
Highly discriminating distance-based topological index
inferredcites →https://doi.org/10.1016/0097-8485(90)80051-3openalex-snapshot
Development of 3-dimensional molecular descriptors
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/s0097-8485(01)00111-5openalex-snapshot
Novel atom-type AI indices for QSPR studies of alcohols
inferredcites →https://doi.org/10.1016/s0097-8485(01)00128-0openalex-snapshot
Application of novel atom-type AI topological indices to QSPR studies of alkanes
inferredcites →https://doi.org/10.1016/s0097-8485(99)00095-9openalex-snapshot
Maximum topological distances based indices as molecular descriptors for QSPR
inferredcites →https://doi.org/10.1016/s0166-1280(97)00151-6openalex-snapshot
3D weighting of molecular descriptors for QSPR/QSAR by the method of ideal symmetry (MIS). 1. Application to boiling points of alkanes
inferredcites →https://doi.org/10.1021/ci00001a013openalex-snapshot
A comment on nomenclature and the unsaturated bond
inferredcites →https://doi.org/10.1021/ci00005a005openalex-snapshot
Comparative study of molecular descriptors derived from the distance matrix
inferredcites →https://doi.org/10.1021/ci00005a006openalex-snapshot
Optimum graph-theoretical models for enthalpic properties of alkanes
inferredcites →https://doi.org/10.1021/ci00014a011openalex-snapshot
Spectrum comparison of IR data taken from different spectrometers with various precision
inferredcites →https://doi.org/10.1021/ci00019a019openalex-snapshot
Prediction of Aqueous Solubility of Organic Compounds
inferredcites →https://doi.org/10.1021/ci00063a012openalex-snapshot
Topological organic chemistry. 1. Graph theory and topological indices of alkanes
inferredcites →https://doi.org/10.1021/ci990061kopenalex-snapshot
Nonlinear Multivariate Regression Outperforms Several Concisely Designed Neural Networks on Three QSPR Data Sets
inferredcites →https://doi.org/10.1021/ja00221a015openalex-snapshot
Molecular modeling of the physical properties of alkanes
inferredcites →https://doi.org/10.1021/ja01193a006openalex-snapshot
Raman Spectra of Aqueous Solutions of Potassium Thiocyanate
inferredcites →https://doi.org/10.1021/ja01617a081openalex-snapshot
Preparation of α-d- and α-l-4-Dimethylamino-1,2-diphenyl-3-methyl-2- propionyloxybutane
inferredcites →https://doi.org/10.1063/1.434593openalex-snapshot
Information theory, distance matrix, and molecular branching
inferredcites →https://doi.org/10.1093/jaoac/62.6.1364bopenalex-snapshot
Lange’s Handbook of Chemistry
inferredcites →https://doi.org/10.1201/9781315380476openalex-snapshot
CRC Handbook of Chemistry and Physics
inferredcites →https://doi.org/10.5860/choice.33-0649openalex-snapshot
Handbook of data on common organic compounds
What points at this work
Incoming claims: where this work appears in other papers’ reference lists and arguments.
inferred← citeshttps://doi.org/10.1002/cem.1303openalex-snapshot
Development of semi‐empirical electrotopological index using the atomic charge in QSPR/QSRR models for alcohols
inferred← citeshttps://doi.org/10.1002/jcc.20700openalex-snapshot
Computational chemistry comparison of stable/nonstable protein mutants classification models based on 3D and topological indices
inferred← citeshttps://doi.org/10.1007/bf02832435openalex-snapshot
QSPR between physical-chemical properties and molecule parameters of alkanes
inferred← citeshttps://doi.org/10.1007/s00894-004-0231-8openalex-snapshot
Semi-empirical topological index: a tool for QSPR/QSAR studies
inferred← citeshttps://doi.org/10.1007/s00894-005-0089-4openalex-snapshot
Novel distance-based atom-type topological indices DAI for QSPR/QSAR studies of alcohols
inferred← citeshttps://doi.org/10.1007/s10953-020-00954-8openalex-snapshot
Atomic-Level Topological Indices for Prediction of the Infinite Dilution Activity Coefficients of Oxo Compounds in Water
inferred← citeshttps://doi.org/10.1007/s10973-022-11859-7openalex-snapshot
Atomic-level AI topological indices as efficient descriptors for developing predictive QSPR models for flash points of acyclic alkanes
inferred← citeshttps://doi.org/10.1007/s11030-005-9006-0openalex-snapshot
Toxicity of Aliphatic Ethers: A Comparative Study
inferred← citeshttps://doi.org/10.1007/s42250-022-00495-1openalex-snapshot
Unified Linear and Nonlinear Models for Retention Prediction of Aliphatic Aldehydes and Ketones in Different Columns and Temperatures: Application of Atom-Type-Based AI Topological Indices
inferred← citeshttps://doi.org/10.1016/b978-0-443-44988-8.00004-6openalex-snapshot
Structural biology in antiviral drug design
inferred← citeshttps://doi.org/10.1016/j.arabjc.2013.11.016openalex-snapshot
Quantitative structure–property relationship study of standard formation enthalpies of acyclic alkanes using atom-type-based AI topological indices
inferred← citeshttps://doi.org/10.1016/j.cplett.2012.05.073openalex-snapshot
The average numbers of outliers over groups of various splits into training and test sets: A criterion of the reliability of a QSPR? A case of water solubility
inferred← citeshttps://doi.org/10.1016/j.jtbi.2008.06.003openalex-snapshot
Enzymes/non-enzymes classification model complexity based on composition, sequence, 3D and topological indices
inferred← citeshttps://doi.org/10.1016/s0169-7439(03)00004-2openalex-snapshot
Atom-type-based AI topological descriptors for quantitative structure–retention index correlations of aldehydes and ketones
inferred← citeshttps://doi.org/10.1023/b:jcam.0000005764.26206.74openalex-snapshot
New atom-type-based AI topological indices: Application to QSPR studies of aldehydes and ketones
inferred← citeshttps://doi.org/10.1023/b:modi.0000047498.49219.abopenalex-snapshot
QSPR modeling the aqueous solubility of alcohols by optimization of correlation weights of local graph invariants
inferred← citeshttps://doi.org/10.1080/10629360600884421openalex-snapshot
Complexity of chemical graphs in terms of size, branching, and cyclicity
inferred← citeshttps://doi.org/10.21203/rs.3.rs-20088/v1openalex-snapshot
Quantitative structure-property relationship study of alcohols water solubility based on a new model combined modified autocorrelation method and electro-topological indices
inferred← citeshttps://doi.org/10.3390/ijms12107250openalex-snapshot
Estimating the Octanol/Water Partition Coefficient for Aliphatic Organic Compounds Using Semi-Empirical Electrotopological Index
inferred← citeshttps://doi.org/10.3390/ijms26199384openalex-snapshot
AI-Integrated QSAR Modeling for Enhanced Drug Discovery: From Classical Approaches to Deep Learning and Structural Insight
inferred← citeshttps://doi.org/10.5772/37798openalex-snapshot
Molecular Interactions in Chromatographic Retention: A Tool for QSRR/QSPR/QSAR Studies
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.