Assess the coverage of a database from the distribution of the distance to the nearest neighbor of each molecule in the database. List the three most similar compounds for each compound in the database.
[Requires: Canvas]
Workflow 
Database Analysis
Used extensions & nodes
Created with KNIME Analytics Platform version 4.1.1
- Go to item
KNIME AG, Zurich, Switzerland
Version 3.7.1
- Go to item
KNIME AG, Zurich, Switzerland
Version 3.7.0
- Go to item
KNIME AG, Zurich, Switzerland
Version 3.7.0
- Go to item
KNIME AG, Zurich, Switzerland
Version 3.7.1
- Go to item
Schrödinger
Versions 19.4.7, 20.2.12, 20.2.58
Loading deployments
Loading ad hoc executions
Legal
By using or downloading the workflow, you agree to our terms and conditions.