NodeBioisostere Replacement

Source

Replace functional groups on a set of ligands with the corresponding bioisosteres, generating all single replacements.
Note: In case of no replacements, the input is passed to the output

Backend implementation

$SCHRODINGER/run apply_transformations.py

Input Ports

  1. Port Type: Data
    Input in Maestro format

Output Ports

  1. Port Type: Data
    Output in Maestro format