On the public citation graph

Quantum Similarity Superposition Algorithm (QSSA): A Consistent Scheme for Molecular Alignment and Molecular Similarity Based on Quantum Chemistry

https://doi.org/10.1021/ci0340153
0 signed · 58 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 See whether every reference in this work resolves to a known work and none has been retracted — and get a dated CiteStamped badge you can embed.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/(sici)1096-987x(19970430)18:6<826::aid-jcc8>3.0.co;2-uopenalex-snapshot
Toward a global maximization of the molecular similarity function: Superposition of two molecules
inferredcites →https://doi.org/10.1002/(sici)1096-987x(199712)18:16<2023::aid-jcc7>3.0.co;2-nopenalex-snapshot
Quantum similarity measures under atomic shell approximation: First order density fitting using elementary Jacobi rotations
inferredcites →https://doi.org/10.1002/1096-987x(20010130)22:2<255::aid-jcc12>3.0.co;2-2openalex-snapshot
TGSA: A molecular superposition program based on topo-geometrical considerations
inferredcites →https://doi.org/10.1002/1097-461x(2000)79:3<163::aid-qua2>3.0.co;2-0openalex-snapshot
Stochastic transformation of quantum similarity matrices and their use in quantum QSAR (QQSAR) models
inferredcites →https://doi.org/10.1002/qsar.19970160605openalex-snapshot
Structure‐Activity Relationships of a Steroid Family using Quantum Similarity Measures and Topological Quantum Similarity Indices
inferredcites →https://doi.org/10.1002/qua.10068openalex-snapshot
Use of promolecular ASA density functions as a general algorithm to obtain starting MO in SCF calculations
inferredcites →https://doi.org/10.1007/978-1-4899-1522-1_3openalex-snapshot
Principles and Applications
inferredcites →https://doi.org/10.1007/978-3-642-57273-9openalex-snapshot
Molecular Quantum Similarity in QSAR and Drug Design
inferredcites →https://doi.org/10.1007/978-94-015-8488-3_1openalex-snapshot
Theoretical Foundation of Quantum Molecular Similarity
inferredcites →https://doi.org/10.1007/bf01165130openalex-snapshot
On quantum molecular similarity measures (QMSM) and indices (QMSI)
inferredcites →https://doi.org/10.1016/s0166-1280(98)00155-9openalex-snapshot
A general survey of molecular quantum similarity
inferredcites →https://doi.org/10.1021/ar010048xopenalex-snapshot
Molecular Quantum Similarity and the Fundamentals of QSAR
inferredcites →https://doi.org/10.1021/ci0004558openalex-snapshot
Modeling Antimalarial Activity: Application of Kinetic Energy Density Quantum Similarity Measures as Descriptors in QSAR
inferredcites →https://doi.org/10.1021/ci010348topenalex-snapshot
Modeling Large Macromolecular Structures Using Promolecular Densities
inferredcites →https://doi.org/10.1021/ci980410vopenalex-snapshot
Three-Dimensional Quantitative Structure−Activity Relationships from Tuned Molecular Quantum Similarity Measures: Prediction of the Corticosteroid-Binding Globulin Binding Affinity for a Steroid Family
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/10.1023/a:1008136520396openalex-snapshot
Use of electron-electron repulsion energy as a molecular descriptor in QSAR and QSPR studies

What points at this work

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

inferred← citeshttps://doi.org/10.1002/9781118431740.ch8openalex-snapshot
Electron Density and Molecular Similarity
inferred← citeshttps://doi.org/10.1002/9781119356059.ch7openalex-snapshot
Continuous Symmetry Measures: A New Tool in Quantum Chemistry
inferred← citeshttps://doi.org/10.1002/9783527628766.biblioopenalex-snapshot
Bibliography
inferred← citeshttps://doi.org/10.1002/jcc.20498openalex-snapshot
Similarity measures based on Gaussian‐type promolecular electron density models: Alignment of small rigid molecules
inferred← citeshttps://doi.org/10.1002/jcc.21532openalex-snapshot
Symmetry measures of the electron density
inferred← citeshttps://doi.org/10.1002/jcc.21644openalex-snapshot
Communications on quantum similarity, part 3: A geometric‐quantum similarity molecular superposition algorithm
inferred← citeshttps://doi.org/10.1002/qua.22510openalex-snapshot
Quantum fidelity for analyzing atoms and fragments in molecule: Application to similarity, chirality, and aromaticity
inferred← citeshttps://doi.org/10.1002/qua.23284openalex-snapshot
Quantum molecular similarity analysis and quantitative definition of catecholamines with respect to biogenic monoamines associated: Scale alpha and beta of quantitative convergence
inferred← citeshttps://doi.org/10.1007/bf02708346openalex-snapshot
Molecular quantum similarity using conceptual DFT descriptors
inferred← citeshttps://doi.org/10.1007/s00214-004-0625-9openalex-snapshot
Geometric and electronic similarities between transition structures for electrocyclizations and sigmatropic hydrogen shifts
inferred← citeshttps://doi.org/10.1007/s00894-007-0251-2openalex-snapshot
Pattern recognition based on color-coded quantum mechanical surfaces for molecular alignment
inferred← citeshttps://doi.org/10.1007/s10910-011-9938-9openalex-snapshot
Molecular fragment shape variation index for functional groups and the holographic properties of electron density
inferred← citeshttps://doi.org/10.1007/s10910-011-9939-8openalex-snapshot
Fragment shape variation index for periodicity deficiency and gradual changes of internal coordinates along linear polymers
inferred← citeshttps://doi.org/10.1007/s10910-012-0119-2openalex-snapshot
Molecular alignment as a penalized permutation Procrustes problem
inferred← citeshttps://doi.org/10.1007/s10910-013-0182-3openalex-snapshot
Theoretical model for the polarization molecular and Hückel treatment of PhosphoCyclopentadiene in an external electric field: Hirschfeld study
inferred← citeshttps://doi.org/10.1007/s10910-024-01663-zopenalex-snapshot
Q-rényi’s divergence as a possible chemical similarity criterion
inferred← citeshttps://doi.org/10.1016/b978-0-32-390257-1.00025-5openalex-snapshot
Quantum similarity description of a unique classical and quantum QSPR algorithm in molecular spaces: the connection with Boolean hypercubes, algorithmic intelligence, and Gödel's incompleteness theorems
inferred← citeshttps://doi.org/10.1016/j.drudis.2007.07.006openalex-snapshot
The role of quantum mechanics in structure-based drug design
inferred← citeshttps://doi.org/10.1016/j.theochem.2005.02.012openalex-snapshot
Molecular quantum similarity of enantiomers of amino acids: a case study
inferred← citeshttps://doi.org/10.1016/j.theochem.2009.10.031openalex-snapshot
3D QSAR based on conceptual DFT molecular fields: Antituberculotic activity
inferred← citeshttps://doi.org/10.1016/j.theochem.2009.12.028openalex-snapshot
Quantum similarity of isosteres coordinate versus momentum space and influence of alignment
inferred← citeshttps://doi.org/10.1017/cbo9780511730412.010openalex-snapshot
The role of quantum mechanics in structure-based drug design
inferred← citeshttps://doi.org/10.1021/ci050491copenalex-snapshot
Coulomb and Overlap Self-Similarities: A Comparative Selectivity Analysis of Structure−Function Relationships for Auxin−like Molecules
inferred← citeshttps://doi.org/10.1021/jp035930uopenalex-snapshot
Similarity and Chirality: Quantum Chemical Study of Dissimilarity of Enantiomers
inferred← citeshttps://doi.org/10.1021/jp061312copenalex-snapshot
Molecular Quantum Similarity of Enantiomers: Substituted Allenes
inferred← citeshttps://doi.org/10.1021/jp070479iopenalex-snapshot
Molecular Quantum Similarity and Chirality: Enantiomers with Two Asymmetric Centra
inferred← citeshttps://doi.org/10.1021/jp711895topenalex-snapshot
Information Theoretical Study of Chirality: Enantiomers with One and Two Asymmetric Centra
inferred← citeshttps://doi.org/10.1021/jp9081883openalex-snapshot
Alternative Kullback−Leibler Information Entropy for Enantiomers
inferred← citeshttps://doi.org/10.1039/b409813gopenalex-snapshot
Molecular similarity: a key technique in molecular informatics
inferred← citeshttps://doi.org/10.1039/c0cp01046dopenalex-snapshot
Information carriers and (reading them through) information theory in quantum chemistry
inferred← citeshttps://doi.org/10.1039/c8cp07002dopenalex-snapshot
Development and application of a comprehensive machine learning program for predicting molecular biochemical and pharmacological properties
inferred← citeshttps://doi.org/10.1063/1.2945894openalex-snapshot
An efficient and accurate molecular alignment and docking technique using ab initio quality scoring
inferred← citeshttps://doi.org/10.1088/0965-0393/22/2/025009openalex-snapshot
Nanocrystal energetics via quantum similarity measures
inferred← citeshttps://doi.org/10.1088/1742-6596/1999/1/012048openalex-snapshot
Study The Spectral and Thermal Properties of The Molecule Tetracene (C18-H12) by Using Semi Empirical Quantum programs
inferred← citeshttps://doi.org/10.1142/s0219633612500150openalex-snapshot
HÜCKEL TREATMENT OF PYRROLE AND PENTALENE AS A FUNCTION OF CYCLOPENTADIENYL USING LOCAL QUANTUM SIMILARITY INDEX (LQSI) AND THE TOPO-GEOMETRICAL SUPERPOSITION APPROACH (TGSA)
inferred← citeshttps://doi.org/10.1201/9781420065442-20openalex-snapshot
Molecular Quantum Similarity
inferred← citeshttps://doi.org/10.1201/9781420065442.ch16openalex-snapshot
Molecular Quantum Similarity
inferred← citeshttps://doi.org/10.1371/journal.pcbi.1004495openalex-snapshot
Developing a Physiologically-Based Pharmacokinetic Model Knowledgebase in Support of Provisional Model Construction
inferred← citeshttps://doi.org/10.17863/cam.16274openalex-snapshot
Molecular Similarity and Xenobiotic Metabolism
inferred← citeshttps://doi.org/10.2174/156802610790232242openalex-snapshot
Quantum Mechanical Methods for Drug Design
inferred← citeshttps://doi.org/10.26565/2312-4334-2023-1-28openalex-snapshot
Semi-Empirical Investigation of Electronic, Vibrational and Thermodynamic Properties of Perylene Molecule (C20H12)
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.