Drug learning

Drug learning is a python package that allows converting molecules from sdf format to fingerprints or molecular descriptors.

Documentation

• Installation
  • From Conda (recommended)
  • From PyPi
  • From Source Code
• Getting Started
  • From python API
    • Transform molecules into fingerprints
    • Set the applicability domain
  • From command line
    • Transform molecules into fingerprints
      • Positional Arguments
      • Named Arguments
      • Sub-commands:
        • split
          • Named Arguments
• ChangeLog
  • 1.0.0