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