OEHBondInteractionHintType¶
This namespace contains constants for the OEHBondInteractionHint interaction type.
See also
OEInteractionHint class
OEHBondInteractionHint class
OEIsHBondInteractionHint functor
ClashAcceptorAcceptor
A hydrogen bond with the
OEHBondInteractionHintType.ClashAcceptorAcceptor type
represents a clashing interaction between a ligand acceptor atom and a
protein acceptor atom.
ClashDonorDonor
A hydrogen bond with the
OEHBondInteractionHintType.ClashDonorDonor type
represents a clashing interaction between a ligand donor atom and a
protein donor atom.
Clash
Warning
This is a deprecated API.
Please use
OEHBondInteractionHintType.ClashAcceptorAcceptor
or
OEHBondInteractionHintType.ClashDonorDonor
instead.
IntramolecularLigand
A hydrogen bond with the
OEHBondInteractionHintType.LigandAccepts type
represents an interaction between a donor and acceptor on the ligand
component.
IntramolecularProtein
A hydrogen bond with the
OEHBondInteractionHintType.ProteinAccepts type
represents an interaction between a donor and acceptor on the protein
component.
LigandAccepts
A hydrogen bond interaction with the
OEHBondInteractionHintType.LigandAccepts
type represents an interaction where the ligand component of an
active site accepts a proton donated by the protein component of
the active site.
LigandDonates
A hydrogen bond interaction with the
OEHBondInteractionHintType.LigandDonates
type represents an interaction where the ligand component of an
active site donates a proton accepted by the protein component of
the active site.
NonIdealLigandAccepts
A hydrogen bond interaction with the
OEHBondInteractionHintType.NonIdealLigandAcceptstype represents an interaction where the bond between the ligand component and a proton donated by the protein component is not ideal.
NonIdealLigandDonates
A hydrogen bond interaction with the
OEHBondInteractionHintType.NonIdealLigandDonatestype represents an interaction where the bond between the ligand component and a proton accepted by the protein component is not ideal.NonIdealProteinAccepts
Same as the
OEHBondInteractionHintType.NonIdealLigandDonatesconstant.NonIdealProteinDonates
Same as the
OEHBondInteractionHintType.NonIdealLigandAcceptsconstant.ProteinAccepts
Same as the
OEHBondInteractionHintType.LigandDonatesconstant.ProteinDonates
Same as the
OEHBondInteractionHintType.LigandAcceptsconstant.UnpairedLigandDonor
A interaction with the
OEHBondInteractionHintType.UnpairedLigandDonortype represents a donor on the ligand component that has no paired acceptor.UnpairedLigandAcceptor
A interaction with the
OEHBondInteractionHintType.UnpairedLigandAcceptortype represents an acceptor on the ligand component that has no paired donor.UnpairedProteinDonor
A interaction with the
OEHBondInteractionHintType.UnpairedProteinDonortype represents a donor on the protein component that has no paired acceptor.UnpairedProteinAcceptor
A interaction with the
OEHBondInteractionHintType.UnpairedProteinAcceptortype represents an acceptor on the protein component that has no paired donor.