OMEGA 4.2.2
Minor bug fixes
Defaults for
-wartsand-flipper_wartshave been changed toFalsein OMEGA.OMEGA now fails robustly when incorrectly attempting to use
-fixsmartswithout providing-fixfileor turning-fromCTtofalse.
Omega TK 4.2.2
Minor bug fixes
The OEOmega method Build will now fail when
MCS matchingis requested but a correspondingFixMolhas not been set.
MolProp TK 2.6.2
Minor internal improvements have been made.