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Molecular Similarity. 1. Analytical Description of the Set of Graph Similarity Measures
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What this work says
Outgoing claims: the papers this work cites, builds on, or argues with.
inferredcites →https://doi.org/10.1007/bf01166045openalex-snapshot
A review and examination of the mathematical spaces underlying molecular similarity analysis
inferredcites →https://doi.org/10.1021/ci00010a009openalex-snapshot
Automatic identification of molecular similarity using reduced-graph representation of chemical structure
inferredcites →https://doi.org/10.1021/ci00018a007openalex-snapshot
Application of graph theoretical parameters in quantifying molecular similarity and structure-activity relationships
inferredcites →https://doi.org/10.1021/ci00025a021openalex-snapshot
On the Basis of Invariants of Labeled Molecular Graphs
inferredcites →https://doi.org/10.1021/ci9604605openalex-snapshot
Four Association Coefficients for Relating Molecular Similarity Measures
What points at this work
Incoming claims: where this work appears in other papers’ reference lists and arguments.
inferred← citeshttps://doi.org/10.1002/qsar.200330831openalex-snapshot
Approaches to Measure Chemical Similarity – a Review
inferred← citeshttps://doi.org/10.1007/978-1-60761-839-3_2openalex-snapshot
Molecular Similarity Measures
inferred← citeshttps://doi.org/10.1007/s10822-014-9719-1openalex-snapshot
Impact of distance-based metric learning on classification and visualization model performance and structure–activity landscapes
inferred← citeshttps://doi.org/10.1016/b978-1-68108-198-4.50007-2openalex-snapshot
On Comparability Graphs: Theory and Applications
inferred← citeshttps://doi.org/10.1016/j.amc.2015.02.042openalex-snapshot
A comparative analysis of the Tanimoto index and graph edit distance for measuring the topological similarity of trees
inferred← citeshttps://doi.org/10.1016/j.amc.2015.05.072openalex-snapshot
Graph distance measures based on topological indices revisited
inferred← citeshttps://doi.org/10.1016/j.amc.2018.01.028openalex-snapshot
Characterizing the optimal pivots for efficient similarity searches in vector space databases with Minkowski distances
inferred← citeshttps://doi.org/10.1016/j.asej.2025.103647openalex-snapshot
Degree-based fuzzy indices analysis of two snake graphs
inferred← citeshttps://doi.org/10.1016/j.compbiolchem.2018.07.003openalex-snapshot
Molecular docking and 4D-QSAR studies of metastatic cancer inhibitor thiazoles
inferred← citeshttps://doi.org/10.1016/j.dam.2016.02.024openalex-snapshot
New inequalities for network distance measures by using graph spectra
inferred← citeshttps://doi.org/10.1016/j.dam.2021.07.006openalex-snapshot
On conjectures of network distance measures by using graph spectra
inferred← citeshttps://doi.org/10.1016/j.ins.2016.01.074openalex-snapshot
Fifty years of graph matching, network alignment and network comparison
inferred← citeshttps://doi.org/10.1016/j.ins.2017.03.036openalex-snapshot
A comparative analysis of new graph distance measures and graph edit distance
inferred← citeshttps://doi.org/10.1016/j.theochem.2003.11.029openalex-snapshot
The combination of principal component analysis, genetic algorithm and tabu search in 3d molecular similarity
inferred← citeshttps://doi.org/10.1021/ci0501342openalex-snapshot
Posetic Quantitative Superstructure/Activity Relationships (QSSARs) for Chlorobenzenes
inferred← citeshttps://doi.org/10.1021/ci9700586openalex-snapshot
Exhaustive Generation of Organic Isomers. 5. Unsaturated Optical and Geometrical Stereoisomers and a New CIP Subrule
inferred← citeshttps://doi.org/10.1023/a:1016387816342openalex-snapshot
Effectiveness of graph-based and fingerprint-based similarity measures for virtual screening of 2D chemical structure databases
inferred← citeshttps://doi.org/10.1023/a:1020784004649openalex-snapshot
A General Analysis of Field-Based Molecular Similarity Indices
inferred← citeshttps://doi.org/10.1039/9781847558879-00001openalex-snapshot
Fragment Descriptors in SAR/QSAR/QSPR Studies, Molecular Similarity Analysis and in Virtual Screening
inferred← citeshttps://doi.org/10.1109/access.2022.3156662openalex-snapshot
Measuring the Similarity of Concept Maps According to Pedagogical Criteria
inferred← citeshttps://doi.org/10.1109/tpds.2026.3729765openalex-snapshot
Hydra-MCS: A Hybrid CPU-GPU Approach to Accelerate the Maximum Common Subgraph Computation
inferred← citeshttps://doi.org/10.1371/journal.pone.0003079openalex-snapshot
Entropy Bounds for Hierarchical Molecular Networks
inferred← citeshttps://doi.org/10.1371/journal.pone.0094985openalex-snapshot
Interrelations of Graph Distance Measures Based on Topological Indices
inferred← citeshttps://doi.org/10.2174/9781608057450113010005openalex-snapshot
Building a Chemical Space Based on Fragment Descriptors
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