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Public

This directory contains 4 workflows.

IconFetching bioactivity data from ChEMBL 

This workflow fetches bioactivity data from ChEMBL and will be used for the PDH KNIME Demonstration on 3/27/2023.

IconWorkflow 1 

Please download the Lipid Maps dataset at https://www.lipidmaps.org/data/structure/index.php After that, input the SDF file into the SDF Reader node. The […]

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Input the LM-ID of any interested lipid(s) in Table Creator node. GET Request node queries the Lipid Maps URL(s). Chemical and physical properties are […]

IconWorkflow 3 

Open the metanodes and input the LM-ID of any appropriate lipid(s) in Table Creator nodes. GET Request node queries the Lipid Maps URL(s). Similarity Search […]