IconStereoizer0 ×

Schrödinger Nodes for Suite2018-1 version 0.0.1.7B27VcMf4_L7A58S5A8G55JS by Schrödinger

Labels stereochemical features or generates structures based upon the chiral properties of the chiral atoms in the structure.

Backend implementation

$SCHRODINGER/utilities/stereoizer
stereoizer is used to process the Maestro input and generate the Maestro output.

Options

Column containing structure
Select column in the data input table containing the structures
Assigning chiralities ignoring geometry
Assigning chiralities using geometry where possible
Generate up to this many stereoisomers
Ensure that the input chiral properties are present in at least one output structure

Input Ports

Input data table containing molecules in Maestro format

Output Ports

Molecules in Maestro format

Views

Std output/error of Stereoizer
Std output/error of Stereoizer

Update Site

To use this node in KNIME, install Schrödinger Nodes for Suite2018-1 from the following update site:

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