Major bug fixes¶
- A bug that caused memory leaks in OMEGA classic, dense, pose, and rocs modes, has been fixed. Previously, a substantial memory leak was experienced when running OMEGA on a large database.
- OMEGA macrocycle no longer uses excessive memory for molecules with terminal heavy atoms.
Minor bug fixes¶
- OMEGA classic no longer omits conformer titles when -includeInput is set to true. Previously, the resulting conformers had no titles.
- Default values of -max_iterations and -maxconfs of OMEGA macrocycle have been changed to 2000 and 400 respectively.