mordred.HydrogenBond module¶

class mordred.HydrogenBond.HBondAcceptor[source]¶

Bases: mordred.HydrogenBond.HBondBase

hydrogen bond acceptor descriptor(rdkit wrapper).

explicit_hydrogens = False¶

kekulize = False¶

require_3D = False¶

require_connected = False¶

rtype¶: alias of int

class mordred.HydrogenBond.HBondDonor[source]¶

Bases: mordred.HydrogenBond.HBondBase

hydrogen bond donor descriptor(rdkit wrapper).

explicit_hydrogens = False¶

kekulize = False¶

require_3D = False¶

require_connected = False¶

rtype¶: alias of int