Fingerprint Based Tools

This category contains 7 nodes.

Canvas Fingerprint Generation Source

Generate molecular fingerprints

Dissimilarity Selection (from Matrix) Source

Dissimilarity Based Compound Selection

Generate Pairwise Matrix Source

Generate pairwise distance matrix

Generate Pairwise Matrix (2 Inputs) Source

Generate pairwise distance matrix from two sets of fingerprints

Hierarchical Clustering Source

Hierarchical Clustering

Hierarchical Clustering Report Source

Reports details for each level of hierarchical clustering based on a pairwise distance matrix. The output table can be used to determine what level […]

Similarity Matrix (from Molecules) Source

Compute similarity (based on fingerprints)