Skip to content

Consider adding bit interpretation of fingerprints #116

@j-adamczyk

Description

@j-adamczyk

Many fingerprints (all descriptors and most hashed ones) in RDKit allow exploration and drawing of fingerprints bits, to aid interpretability. We should consider:

  1. How hard would it be to add this (probably would require something more than just NumPy arrays like now)
  2. What would be the additional computational cost

Metadata

Metadata

Assignees

No one assigned

    Labels

    enhancementNew feature or request

    Type

    No type

    Projects

    No projects

    Milestone

    No milestone

    Relationships

    None yet

    Development

    No branches or pull requests

    Issue actions