Perceive and Print Protein-Ligand Interactions

The program that perceives protein-ligand interactions and prints them out.

An example command would be:

prompt> printinteractions.py complex.pdb

Code

Download code

printinteractions.py

See also

• OESplitMolComplex function

• OEInteractionHintContainer class

• OEGetActiveSiteInteractionHintTypes function

• OEInteractionHint and OEInteractionHintFragment classes

• OEIsValidActiveSite function

• OEPerceiveInteractionHints function

• OEGetResidues function

• OELigandInteractionHintComponent and OEProteinInteractionHintComponent classes

• OEHasResidueInteractionHint and OEHasInteractionHint predicate classes