CHA Re-Score

The CHA Re-Score node reads hit-lists (usually from the activity profiling node) and re-scores them according to their activity profiles. The resulting new scores are added as molecule properties to the output table.

Options

Settings

Exclude all molecules with zero actvity profile
When this option is active, all molecules with a zero activity profile are excluded.
(Default: disabled)

Input Ports

Icon
Table containing the hit-lists (molecule tables usually retrieved from the 'Activity Profiling' node)
Icon
Table containing the pharmacophore models from the CHA Filter Node

Output Ports

Icon
Table containing the molecules with CHA scores

Popular Predecessors

Popular Successors

Views

This node has no views

Workflows

  • No workflows found

Links

Developers

You want to see the source code for this node? Click the following button and we’ll use our super-powers to find it for you.

Installation

To use this node in KNIME, install the extension LigandScout Extensions for the KNIME Workbench from the below update site following our NodePit Product and Node Installation Guide:

v5.3

A zipped version of the software site can be downloaded here.

Plugin provider: InteLigand GmbH
Plugin version: 1.9.3
On NodePit since: 2024-07-09
Last update: 2024-11-21
KNIME versions: v5.3, v5.2, v5.1, v4.7, v4.6, v4.5, v4.4, v4.3, v4.2, v4.1

Deploy, schedule, execute, and monitor your KNIME workflows locally, in the cloud or on-premises – with our brand new NodePit Runner.

Try NodePit Runner!