All issues

deduce_method_type() substring-matches 'am' inside 'cam-b3lyp': every CAM functional types as semi-empirical

#1049

· alongd opened

on Sep 8, 2026

Reaction multiplicity silently resolves to 1 when species are attached after first access

#1048

· kfir4444 opened

on Sep 7, 2026

Linear adapter returns no guess for one requested atom map, and reports success anyway

#1045

· kfir4444 opened

on Sep 7, 2026

Reaction label is not validated when reactants/products are given, causing a late IndexError in flip_reaction

#1043

· kfir4444 opened

on Sep 7, 2026

LinearAdapter silently ignores a pre-set atom map, returning identical TS guesses for different maps

#1042

· kfir4444 opened

on Sep 7, 2026

deduce_method_type substring-matches 'am' inside 'cam', so CAM-B3LYP types as semiempirical and open-shell species run restricted

#1033

· alongd opened

on Aug 31, 2026

NMD check rejects a likely-correct late H_Abstraction TS, and deletes the IRC jobs that would adjudicate it

#1002

· alongd opened

on Aug 19, 2026

Level: unify the 'does this level carry meaningful args?' predicate between str and as_dict()

#987

· alongd opened

on Aug 15, 2026

Brute-force directed scans optimize freely at every point (Scheduler.run_job passes constraints=None) — flat V(φ)

#986

· alongd opened

on Aug 15, 2026

Flaky: test_initialize_output_dict fails intermittently under xdist (order-dependent)

#984

· alongd opened

on Aug 14, 2026

Local pipe: concurrent arrays oversubscribe the CPU budget (stateless local_worker_limit)

#961

· alongd opened

on Aug 11, 2026

improved trsh

#933

· alongd opened

on Jul 28, 2026