Package CHEM :: Package CombiCDB :: Module MolecularWeightPools :: Class MoleculeByWeight

Class MoleculeByWeight

Simple wrapper class for OEMolBases. Override __cmp__ method so that the molecules will be sorted by their molecular weight.

Instance Methods

__init__(self, mol)
Initialize with the given OEMolBase

__cmp__(self, other)
Override comparison method so molecules will be sorted by molecular weight

getMol(self)

getWeight(self)

calculateWeight(self)

Class Variables

HYDROGEN_ATOMIC_NUM = 1

mMol = <CHEM.DB.rdb.search.NameRxnPatternMatchingModel.SearchS...

mWeight = -1

Class Variable Details

Value:

None