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)