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AutoQSAR

Cheminformatics AutoQSAR
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Generate QSAR models for a chosen property of a set of compounds, and apply the QSAR model to other compounds, with traditional QSAR methods.

Used extensions & nodes

Created with KNIME Analytics Platform version 4.3.2 Note: Not all extensions may be displayed.
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    Schrödinger Extensions for KNIME Trusted extension

    Schrödinger

    Versions 19.4.7, 21.1.125, 21.1.135

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