MolProp TK 2.2.1¶
Major bug fixes¶
- OEGetXLogP will no longer return garbage data in the per atom data array whenever molecules with deleted atoms are passed to the function.
- OEFilter carboxylic acid pattern will now match formic acid, formic esters, and formic thioesters with implicit hydrogens. Previously, explicit hydrogens were required on the molecule.
Minor bug fixes¶
- Removed unbounded stack allocations.