Lexichem TK 2.3.2¶
New features¶
Added phosphorous oxychloride, and gleevec to the dictionary.
Added a number of additional ring templates.
Added support for isotopes in naming metal linking groups.
Added structure to name support for deuterated water and phosphoryl trichloride.
OEParseIUPACName
andOECreateIUPACName
will now release the Python global interpreter lock while running.
Major bug fixes¶
Fixed a memory leak in structure to name generation for simple tricyclic fused ring systems.
Minor bug fixes¶
Reverted a regression in names like (R)-2-(1H-indol-1-yl)propanoic acid, where the locant position for the CIP stereo center was previously automatically determined.
Updated the dictionary entry for lipitor to have two atorvastatin molecules and the water of crystallization.
Updated anthramycin’s representation to be canonical and isomeric.
Tweaked the parser to correctly parse cyclosporin A without a warning.