This node is currently not available in KNIME v5.3 — instead we’re showing this page for KNIME v4.5. You can use the version menu in the title bar to permanently switch your preferred version. This will also show the link to the update site.

MolConfGen

KNIME node interface to _confGen script

Options

Sample Rings: Sample flexible rings
Sample CisTrans: Sample cis/trans configuration around double bond
Cartesian minimization: Cartesian minimization
Sample pyramid nitrogen: Sample pyramid nitrogen
Number of Parallel Processes: (Unix/Mac only) spawn addition docking jobs

Input Ports

: Input Molecules

Output Ports

: Output Molecules

Popular Predecessors

Popular Successors

Views

name of first view: Description of first view...

Workflows

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Developers

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Installation

To use this node in KNIME, install the extension Molsoft Knime Nodes from the below update site following our NodePit Product and Node Installation Guide:

v4.5

Plugin provider: Molsoft LLC

Plugin version: 1.0.2.25

On NodePit since: 2021-12-06

Last update: 2022-04-19

KNIME versions: From v3.6 to v4.5

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