There are 2898 nodes that can be used as successor for a node with an output port of type Table.
Calculates predicted activity for molecules using a kNN model generated with Flare™ or the 'Flare Build kNN' node. If the model was generated using […]
Flare™ Align is a tool for aligning a set of molecules to one or more reference molecules in a pre-defined conformation.
Flare™ Docking is a node to run docking and scoring experiments using the Lead Finder™ docking algorithm, now fully integrated in Flare.
Launches Flare™ to view ligand and protein structures.
Runs a Python script using pyflare. The scripts have access to Flare™ Python API.
Generates RDKit molecules from a molecule string representation (SMILES, SDF or SMARTS).
Converts RDKit molecules into string based molecule representations (SDF or Smiles).
Converts InChI codes to RDKit molecules.
Converts RDKit molecules into InChI Codes and optionally also into InChI Keys.
Converts IUPAC names to RDKit molecules.
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