Omega TK 2.5.7¶
Minor bug fixes¶
The OEOmega constructor will now initialize all data members appropriately to avoid subtle unreproducible errors based on random values in memory.
Calling SetWarts with true had been broken until the 2014.Oct release. The output conformers would have the numeric index(wart) in the
.oebformat but not the.sdfformat. This is now fixed. The default behavior of OETautomerOptions has been changed fromtruetofalsewhen applying a numeric index(wart) to titles.
C#-specific changes¶
OETorLib.AddTorsionRuleis now usable from C#.