mooonpy

Installation:

  • Using pip from PyPi
  • Using pip locally
  • Dependency List
  • Simple Python example

MolSpace:

  • mooonpy.molspace package
    • Subpackages
      • mooonpy.molspace.graph_theory package
        • Submodules
    • Submodules

ThermoSpace:

  • mooonpy.thermospace package

XRDSpace:

  • mooonpy.xrdspace package

Programs:

  • mooonpy.programs package

GUIs:

  • mooonpy.guis package

Tools:

  • mooonpy.tools package

Examples:

  • Example: 1
mooonpy
  • mooonpy.molspace package
  • mooonpy.molspace.graph_theory package
  • View page source

mooonpy.molspace.graph_theory package

Submodules

  • mooonpy.molspace.graph_theory.interface module
    • find_cumulative_neighs()
    • find_reachable_neighbors()
    • find_reachable_neighbors_all()
    • generate_graph()
    • steps_from_initiator()
  • mooonpy.molspace.graph_theory.ring_analysis module
    • find_rings()
    • ring_canonical()
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