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Clustering a large number of compounds. 2. Using the connection machine

https://doi.org/10.1021/ci00002a022
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inferred← citeshttps://doi.org/10.1002/0471433519.ch1openalex-snapshot
Clustering Methods and Their Uses in Computational Chemistry
inferred← citeshttps://doi.org/10.1002/9780470125847.ch1openalex-snapshot
Similarity Searching in Databases of Chemical Structures
inferred← citeshttps://doi.org/10.1002/9783527615674.ch3openalex-snapshot
Rational Use of Chemical and Sequence Databases
inferred← citeshttps://doi.org/10.1007/0-306-46873-5_6openalex-snapshot
Subset-Selection Methods For Chemical Databases
inferred← citeshttps://doi.org/10.1007/978-3-642-57991-2_29openalex-snapshot
Clustering Algorithms and Cluster Validation
inferred← citeshttps://doi.org/10.1007/bf00126218openalex-snapshot
A fast and efficient method for 2D and 3D molecular shape description
inferred← citeshttps://doi.org/10.1016/s0169-7439(97)00073-7openalex-snapshot
Data structure comparison using fractal analysis
inferred← citeshttps://doi.org/10.1016/s0169-7439(98)00085-9openalex-snapshot
Representative subset selection using genetic algorithms
inferred← citeshttps://doi.org/10.1021/ci0600859openalex-snapshot
A Fast Clustering Algorithm for Analyzing Highly Similar Compounds of Very Large Libraries
inferred← citeshttps://doi.org/10.1021/ci200061popenalex-snapshot
Accelerating Two Algorithms for Large-Scale Compound Selection on GPUs
inferred← citeshttps://doi.org/10.1021/ci9501047openalex-snapshot
Use of Structure−Activity Data To Compare Structure-Based Clustering Methods and Descriptors for Use in Compound Selection
inferred← citeshttps://doi.org/10.1021/ci9604605openalex-snapshot
Four Association Coefficients for Relating Molecular Similarity Measures
inferred← citeshttps://doi.org/10.1021/ci980103popenalex-snapshot
Rational Combinatorial Library Design. 3. Simulated Annealing Guided Evaluation (SAGE) of Molecular Diversity: A Novel Computational Tool for Universal Library Design and Database Mining
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