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Development of a Spectral Clustering Method for the Analysis of Molecular Data Sets

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

inferredcites →https://doi.org/10.1006/cviu.1997.0637openalex-snapshot
Quantitative Measures of Change Based on Feature Organization: Eigenvalues and Eigenvectors
inferredcites →https://doi.org/10.1016/0223-5234(87)90020-1openalex-snapshot
Similarity and clustering in chemical information systems
inferredcites →https://doi.org/10.1021/ci0342674openalex-snapshot
Clustering Files of Chemical Structures Using the Fuzzy k -Means Clustering Method
inferredcites →https://doi.org/10.1021/ci0500029openalex-snapshot
A Hierarchical Clustering Approach for Large Compound Libraries
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Database Clustering with a Combination of Fingerprint and Maximum Common Substructure Methods
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NIPALSTREE: A New Hierarchical Clustering Approach for Large Compound Libraries and Its Application to Virtual Screening
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A Cluster-Based Strategy for Assessing the Overlap between Large Chemical Libraries and Its Application to a Recent Acquisition
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Use of Structure−Activity Data To Compare Structure-Based Clustering Methods and Descriptors for Use in Compound Selection
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The Information Content of 2D and 3D Structural Descriptors Relevant to Ligand-Receptor Binding
inferredcites →https://doi.org/10.1021/ci9800211openalex-snapshot
Chemical Similarity Searching
inferredcites →https://doi.org/10.1021/ci990162iopenalex-snapshot
The Characterization of Chemical Structures Using Molecular Properties. A Survey
inferredcites →https://doi.org/10.1021/jm040213popenalex-snapshot
A Robust Clustering Method for Chemical Structures
inferredcites →https://doi.org/10.1021/jm049032dopenalex-snapshot
HierS: Hierarchical Scaffold Clustering Using Topological Chemical Graphs
inferredcites →https://doi.org/10.1038/nchembio747openalex-snapshot
Analysis of drug-induced effect patterns to link structure and side effects of medicines
inferredcites →https://doi.org/10.1073/pnas.0407790101openalex-snapshot
Biological spectra analysis: Linking biological activity profiles to molecular structure
inferredcites →https://doi.org/10.2174/0929867003374417openalex-snapshot
Recent Advances in Inducible Cyclooxygenase (COX-2) Inhibition.

What points at this work

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

inferred← citeshttps://doi.org/10.1002/chin.200749224openalex-snapshot
Development of a Spectral Clustering Method for the Analysis of Molecular Data Sets.
inferred← citeshttps://doi.org/10.1016/j.bmcl.2008.12.065openalex-snapshot
Discovery of novel inhibitors of Trypanosoma cruzi trans-sialidase from in silico screening
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Picking up the pieces with FBDD or FADD: invest early for future success
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Fighting Obesity with a Sugar-Based Library: Discovery of Novel MCH-1R Antagonists by a New Computational–VAST Approach for Exploration of GPCR Binding Sites
inferred← citeshttps://doi.org/10.1021/ci500480bopenalex-snapshot
Investigation of the Use of Spectral Clustering for the Analysis of Molecular Data
inferred← citeshttps://doi.org/10.1089/adt.2010.0322openalex-snapshot
Using Electrophysiology and In Silico Three-Dimensional Modeling to Reduce Human Ether-à-go-go Related Gene K + Channel Inhibition in a Histamine H3 Receptor Antagonist Program
inferred← citeshttps://doi.org/10.1093/nar/gkp075openalex-snapshot
Integration of phenotypic metadata and protein similarity in Archaea using a spectral bipartitioning approach
inferred← citeshttps://doi.org/10.1111/j.1747-0285.2007.00579.xopenalex-snapshot
A Similarity‐based Data‐fusion Approach to the Visual Characterization and Comparison of Compound Databases
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The complete genome sequence of Staphylothermus marinus reveals differences in sulfur metabolism among heterotrophic Crenarchaeota
inferred← citeshttps://doi.org/10.1186/s13321-022-00607-6openalex-snapshot
Pharmacological affinity fingerprints derived from bioactivity data for the identification of designer drugs
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Genomic Characterization of Methanomicrobiales Reveals Three Classes of Methanogens
inferred← citeshttps://doi.org/10.1371/journal.pone.0020237openalex-snapshot
Novel Insights into the Diversity of Catabolic Metabolism from Ten Haloarchaeal Genomes
inferred← citeshttps://doi.org/10.1504/ijcbdd.2013.052200openalex-snapshot
Multi-view spectral clustering and its chemical application
inferred← citeshttps://doi.org/10.21203/rs.3.rs-1316376/v1openalex-snapshot
Catch the next designer drug: bioactivity data derived pharmacological affinity fingerprints and performance in similarity searching and unsupervised clustering
inferred← citeshttps://doi.org/10.4236/jbise.2009.26056openalex-snapshot
Classification with binary gene expressions
inferred← citeshttps://doi.org/10.5402/2012/381023openalex-snapshot
A Robust Topology-Based Algorithm for Gene Expression Profiling
inferred← citeshttps://doi.org/10.6084/m9.figshare.20024683openalex-snapshot
Additional file 1 of Pharmacological affinity fingerprints derived from bioactivity data for the identification of designer drugs
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