Molecule Clustering in Visualization The CDD Vault Visualization tool now has a new “plot type” for clustering. Clicking the Cluster analysis tool will: give you an option to set a Tanimoto similarity threshold perform the clustering algorithm across all structures Add a new “Cluster ID” col...
CDD Vault Update (April 2023): Cluster Analysis, Substructures as Parameters, Search filters in Visualization, and a Tautomer Parameter for the API Molecule Clustering in Visualization The CDD Vault Visualization tool now has a new “plot type” for clustering. Clicking the Cluster analysis tool will: give you an option to set a Tanimoto similarity threshold perform the clustering algorithm across all structures Add a new “Cluster ID” column to the data table Cluster ID is now available… by Abe Wang, CDD Webpage: https://ift.tt/mcvfQX7 Bengaluru: April 15, 2023 at 09:23AM |
Zastra's JournalArchives
April 2023
Categories |