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.