Maarten L. Hekkelman 025ad93d06 add more tests ...

don't use get_item_indices
version bump

2026-05-18 12:17:31 +02:00

..

reconstruct

Fix reconstruction, and reconstruction test files

2026-04-21 11:39:50 +02:00

1cbs-dssp.cif

Updated test file

2025-05-12 11:56:42 +02:00

1juh.cif.gz

using index in category

2022-10-03 16:22:32 +02:00

2bi3.cif.gz

symmetry operations now working correctly

2023-04-13 11:42:59 +02:00

3bwh.cif.gz

test data

2023-04-17 20:54:57 +02:00

4wvp.cif.gz

more test cases

2023-04-17 18:56:02 +02:00

476d.cif.gz

Fix symmetry operations

2026-03-31 15:48:21 +02:00

brak.pdb

Fix parsing bogus PDB files (with REMARK 001)

2025-04-02 11:29:25 +02:00

CMakeLists.txt

first merge

2026-02-13 13:53:45 +01:00

cql-test.cpp

documenting

2026-02-25 17:16:09 +01:00

dssp-extension.dic

Merged develop manually

2025-04-09 09:20:53 +02:00

HEM.cif

Reactivated several structure methods

2022-10-03 09:32:20 +02:00

io-test.cpp

Update documentation, add more license and copyright info

2026-03-02 11:20:59 +01:00

matrix-test.cpp

Fix matrix multiplication

2026-03-04 20:28:04 +01:00

model-test.cpp

Update validation code, added pdbx_item_enumeration check and test case-sensitive when required.

2026-04-13 10:38:43 +02:00

pdb1cbs.ent.gz

Add formula_weight to entity in pdb2cif

2023-12-13 16:27:41 +01:00

query-test.cpp

change path of main include file

2026-02-18 15:10:12 +01:00

REA_v2.cif

More documentation

2023-09-13 10:22:28 +02:00

REA.cif

Use index in lookup, when available

2022-10-04 13:57:38 +02:00

reconstruction-test.cpp

Remove debug statement

2026-03-31 08:41:04 +02:00

rename-compound-test.cpp

change path of main include file

2026-02-18 15:10:12 +01:00

RXA.cif

Use index in lookup, when available

2022-10-04 13:57:38 +02:00

spinner-test.cpp

Develop (#54)

2024-02-17 16:03:14 +01:00

sugar-test.cpp

change path of main include file

2026-02-18 15:10:12 +01:00

test-main.cpp

Update documentation, add more license and copyright info

2026-03-02 11:20:59 +01:00

test-main.hpp

Update catch2 usage

2025-09-24 13:25:56 +02:00

UN_.cif

Use index in lookup, when available

2022-10-04 13:57:38 +02:00

unit-3d-test.cpp

automatic include generation is evil

2026-04-02 09:36:34 +02:00

unit-v2-test.cpp

add more tests

2026-05-18 12:17:31 +02:00

validate-pdbx-test.cpp

change path of main include file

2026-02-18 15:10:12 +01:00