Shape TK 2.0.3¶

New features¶

A new overload of OEWriteShapeQuery has been added that writes queries to an oeostream object.

Minor bug fixes¶

OEAnalyticShapeFunc and OEGridShapeFunc now produce a value of 1.0 for self-shape Tanimoto.
OEOverlay now properly handles empty query objects and queries consisting of only color atoms.
OEOverlay now properly handles molecules without coordinates.
The OEColorFunc assignment operator has been fixed.

Documentation changes¶

Code examples in the Examples section have been revised.