- Type: TableMolecule libraryThe molecule library to be processed.
Node details
Input ports
Output ports
- Type: TableProcessed moleculesTable with the read molecules.
Extension
The Ligand Preparation node is part of this extension:
Related workflows & nodes
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Pharmacelera_Standard_VS
Workflow to perform 3D Ligand-Based Virtual Screening with PharmScreen. - To run the workflow fill each option of the S…pharmacelera > Public > Pharmacelera_Standard_VS -
Pharmacelera_LigandPreparation_MultiServer
Workflow to run the molecular parameterization, with PharmScreen, remotely on a variable number of machines. - To run t…pharmacelera > Public > Pharmacelera_LigandPreparation_MultiServer -
Pharmacelera_VS_ROCcurve
Workflow to perform 3D Ligand-Based Virtual Screening benchmark with PharmScreen. - To run the workflow fill each optio…pharmacelera > Public > Pharmacelera_VS_ROCcurve -
Pharmacelera_VS_ChEMBL_Search
Workflow to perform 3D Ligand-Based Virtual Screening with PharmScreen and searching for the results on the ChEMBL Data…pharmacelera > Public > Pharmacelera_VS_ChEMBL_Search
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