Compare Ligand Sets

Compares and writes a file that contains a subset of structures in file1 and file2, depending on the selected mode

Backend implementation

compare_ligand_files.py
The script compare_ligand_files.py is used to implement this node.

Input ports

1. Type: Table
   Molecules in Maestro format
   First Input Molecules in Maestro format
2. Type: Table
   Molecules in Maestro format
   Second Input Molecules in Maestro format

Output ports

1. Type: Table
   Molecules in Maestro format
   Output Molecules in Maestro format