f scheduler

Author: alongd

arc/scheduler.py

@@ -1719,12 +1719,17 @@ def spawn_ts_jobs(self):
                     for method in self.ts_adapters:
                         family_known = (rxn.family is not None
                                         and rxn.family in ts_adapters_by_rmg_family)
+                        admit_unknown_family = (not family_known
+                                                and method in ts_adapters_for_unknown_unimolecular
+                                                and rxn.is_unimolecular())
                         if method in all_families_ts_adapters \
                                 or (family_known and method in ts_adapters_by_rmg_family[rxn.family]) \
-                                or (not family_known
-                                    and method in ts_adapters_for_unknown_unimolecular
-                                    and rxn.is_unimolecular()) \
+                                or admit_unknown_family \
                                 or 'mock' in method:
+                            if admit_unknown_family:
+                                logger.info(f'Admitting TS adapter {method!r} for reaction {rxn.label} '
+                                            f'via ts_adapters_for_unknown_unimolecular '
+                                            f'(RMG family is {rxn.family!r}).')
                             self.run_job(job_type='tsg',
                                          job_adapter=method,
                                          reactions=[rxn],