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Molsoft
This category contains 16 nodes.
MolAPFSuperimpose
Flexible APF Superposition.
MolCalcProp
Calculates Various Properties and descriptors for the input set of molecules
MolcartReader
Molcart reader node
MolCenters
Selects representatives from chemical clustering.
MolCluster
Chemical tree clustering node.
MolConfGen
Conformation Generator
MolConvertTo3D
2D to 3D conversion
MolIcmDock
Molsoft small molecule docking node.
MolIcmDockPrep
Docking receptor/project preparation node. (Icm version 3.8-1 or grater is required for this node)