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2D Sketcher

Opens 2D Sketcher

Backend implementation

$SCHRODINGER/utilities/2d_sketcher

Options

Sketch molecules...: This button brings up the "2D Sketcher" to sketch or edit the molecules
Buttons in 2D Sketcher
Entries: List all the sketched entries
Save As New: Save the current structure in the sketcher as new entry to the 'Entries' list
Update Entry: Update the current entry in 'Entries' list with the structure in the sketcher
Delete Entry: Delete the current entry from 'Entries' list
Reset: Resets the current entry in 'Entries' list to its initial state

Input Ports

This node has no input ports

Output Ports

: Sketched molecules in Smiles format

Popular Predecessors

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Views

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Workflows

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Developers

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Installation

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

v5.2

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

Plugin provider: Schrödinger

Plugin version: 24.3.138.v202407300410

On NodePit since: 2023-12-06

Last update: 2024-12-18

KNIME versions: v5.2, v5.1, v4.7, v4.6, v4.5, v4.4, v4.1

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