This node assesses the affinity of a protein-ligand complex with
HYDE, given a library table with molecules in sdf or mol2
format, and a protein table with entries in pdb format.
The HYDE score and the assessment details will be sent to the
output port.
HYDE has to be licensed separately, see
https://www.biosolveit.de/HYDE for more details.
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To use this node in KNIME, install the extension BioSolveIT Hydescorer for Knime from the below update site following our NodePit Product and Node Installation Guide:
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