Compound
========

.. currentmodule:: pyopenms

.. autoclass:: Compound
   :members:
   :undoc-members:
   :show-inheritance:
   :inherited-members:
   
   
   .. automethod:: __init__

   
   .. rubric:: Methods

   .. autosummary::
   
      ~Compound.__init__
      ~Compound.addCVTerm
      ~Compound.clearMetaInfo
      ~Compound.consumeCVTerms
      ~Compound.empty
      ~Compound.getCVTerms
      ~Compound.getChargeState
      ~Compound.getKeys
      ~Compound.getMetaValue
      ~Compound.getRetentionTime
      ~Compound.getRetentionTimeType
      ~Compound.getRetentionTimeUnit
      ~Compound.hasCVTerm
      ~Compound.hasCharge
      ~Compound.hasRetentionTime
      ~Compound.isMetaEmpty
      ~Compound.metaRegistry
      ~Compound.metaValueExists
      ~Compound.removeMetaValue
      ~Compound.replaceCVTerm
      ~Compound.replaceCVTerms
      ~Compound.setCVTerms
      ~Compound.setChargeState
      ~Compound.setMetaValue
   
   

   
   
   .. rubric:: Attributes

   .. autosummary::
   
      ~Compound.id
      ~Compound.molecular_formula
      ~Compound.rts
      ~Compound.smiles_string
      ~Compound.theoretical_mass