The MMFF94 Library Minimizer node allows the energy minimization of an arbitrary amount of molecules.
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.
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:
A zipped version of the software site can be downloaded here.
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