OEDepict TK 2.3.2¶
New features¶
OE2DMolDisplayOptions.GetAtomVisibilityFunctor
andOE2DMolDisplayOptions.SetAtomVisibilityFunctor
methods have been added to support the ability to selectively hide portions of a structure from depictions.OEAlignmentOptions.SetAddDepictionHydrogens
andOEAlignmentOptions.GetAddDepictionHydrogens
methods have been added to control depiction hydrogens added during molecule alignment.OEGetAverageBondLengthInDispCoords
function has been added.OEGetNearbyAtom
andOEGetNearbyBond
functions have been added.OENearestAtom and OENearestBond classes now store the display position of the nearest atom and bond, respectively.
Major bug fixes¶
A memory issue that caused
OEPrepareAlignedDepiction
function to crash has been fixed. The performance of molecule alignment has been also improved.
Minor bug fixes¶
Clashes between atom labels and inside bond lines of rings have been eliminated in cases when font scales larger than the default value were used. See the example below.
2016.Feb
2016.Jun
C#-specific changes¶
OEImageBase.DrawArc
method no longer throws an “Out Of Memory”
error message when drawing an arc with a small angle and/or small radius.
For more details, see
Graphics.DrawArc Method.
Documentation changes¶
All images in the OEDepict TK documentation were automatically regenerated to reflect the changes made since the previous release.