5 Commits

Author SHA1 Message Date
Maarten L. Hekkelman
56c75490f2 Fix reconstruction, and reconstruction test files 2026-04-21 11:39:50 +02:00
Maarten L. Hekkelman
6df8b435ec Fix reconstruction of pdbx_poly_seq_scheme, again... 2026-03-25 16:16:24 +01:00
Maarten L. Hekkelman
57aaf36bde Fix regression in reconstruct 2026-03-25 09:58:45 +01:00
Maarten L. Hekkelman
9f3a0b5c4c cleaning up mostly done now 2026-01-13 08:59:40 +01:00
Maarten L. Hekkelman
e59750386f - changed compound::is_known_peptide/is_know_base
- Add audit_conform only if file is really valid
- Added reconstruction code for PDBx
2024-01-24 16:14:08 +01:00