mordred.TPSA module

class mordred.TPSA.TPSA(no_only=True)

Bases: mordred._base.Descriptor

topological polar surface area descriptor(NO only: rdkit wrapper).

Parameters:no_only (bool) –

• True: N,O only TPSA
• False: all(N,O,S,P) TPSA

References

• [ERS00]

explicit_hydrogens = True

gasteiger_charges = False

kekulize = False

require_connected = False

rtype

alias of float