Commit Graph

340 Commits

Author SHA1 Message Date
Maarten L. Hekkelman
933eb368c9 Update changelog 2025-05-14 16:22:00 +02:00
Maarten L. Hekkelman
b88c72b53c Update readme 2025-05-14 16:20:57 +02:00
Maarten L. Hekkelman
152b8f1018 Added unit test for python module 2025-05-14 16:08:19 +02:00
Maarten L. Hekkelman
ff471530ce Build and install python plugin 2025-05-14 13:56:30 +02:00
Maarten L. Hekkelman
127502d384 Reduce changes in libdssp 2025-05-14 11:41:47 +02:00
Maarten L. Hekkelman
5218294347 First working version 2025-05-14 11:33:21 +02:00
Maarten L. Hekkelman
f6b3943d3d Merge branch 'trunk' of github.com:PDB-REDO/dssp into trunk v4.5.1 2025-05-12 14:41:04 +02:00
Maarten L. Hekkelman
0c320d82e2 fix dictionary location 2025-05-12 14:40:53 +02:00
Maarten L. Hekkelman
7a44dce307 fix dictionary location 2025-05-12 14:39:35 +02:00
Maarten L. Hekkelman
00eec9f35c Updated changelog 2025-05-12 12:08:48 +02:00
Maarten L. Hekkelman
86efff8ada updates for audit_conform 2025-05-12 12:07:09 +02:00
Maarten L. Hekkelman
c4bdece38e Only use reconstructing load when needed, saves a lot of time 2025-05-12 09:28:37 +02:00
Maarten L. Hekkelman
ec1ded8087 Version bump v4.5.0 2025-04-09 09:56:01 +02:00
Maarten L. Hekkelman
28dad5c0cc fix test makefile 2025-04-09 09:50:05 +02:00
Maarten L. Hekkelman
bb25e3a8e3 fix tests in clean environment 2025-04-09 09:43:40 +02:00
Maarten L. Hekkelman
6c69aca353 Merge branch 'develop' into trunk 2025-04-09 09:38:39 +02:00
Maarten L. Hekkelman
a99f53ac18 documentation runner 2025-04-09 09:36:47 +02:00
Maarten L. Hekkelman
45b75212c8 Updated makefile to include correct libcifpp, update Dockerfile 2025-04-09 09:30:23 +02:00
Maarten L. Hekkelman
c57c39706f Fixes required for new libcifpp 8 2025-04-02 13:48:05 +02:00
Maarten L. Hekkelman
3cbec3abea Add dictionary to audit_conform v4.4.11 2025-02-26 09:16:36 +01:00
Maarten L. Hekkelman
a7f2106f63 Fix mcfp dependency 2025-02-20 07:25:44 +01:00
Maarten L. Hekkelman
22aa1933d9 switch to catch2 v3 2025-02-05 16:45:36 +01:00
Maarten L. Hekkelman
aad70b9ea5 switch to catch2 v3 2025-02-05 16:43:30 +01:00
Maarten L. Hekkelman
54fa209d80 Merge branch 'trunk' of github.com:PDB-REDO/dssp into trunk 2025-02-05 16:41:41 +01:00
Maarten L. Hekkelman
79bf663fd1 switch to catch2 v3 2025-02-05 16:41:36 +01:00
Maarten L. Hekkelman
869617ccde FIx incorrect git url 2025-01-22 18:40:41 +01:00
Maarten L. Hekkelman
787b6fff3e FIx incorrect git url 2025-01-22 18:38:03 +01:00
Maarten L. Hekkelman
70ac0f7a6a update libmcfp dependency 2025-01-22 11:27:16 +01:00
Maarten L. Hekkelman
eb712e9feb remove building documentation @github 2025-01-15 12:49:34 +01:00
Maarten L. Hekkelman
03a91ffd33 fix doc building? 2025-01-15 12:47:43 +01:00
Maarten L. Hekkelman
8fd8d96711 build docs @github - take 2 2025-01-15 12:42:12 +01:00
Maarten L. Hekkelman
f0ab42a1c8 build docs @github 2025-01-15 12:38:49 +01:00
Maarten L. Hekkelman
4bee8e336d Fix dssp extension dictionary 2025-01-15 12:31:55 +01:00
Maarten L. Hekkelman
7b87dacb33 version bump v4.4.10 2024-10-16 08:15:43 +02:00
Maarten L. Hekkelman
dfd688476e Merge branch 'trunk' into develop 2024-10-16 08:14:22 +02:00
Maarten L. Hekkelman
f554bfd300 Fix install when building cifpp ourselves 2024-10-16 08:12:01 +02:00
Maarten L. Hekkelman
0db97c2e94 Another attempt to build on windows 2024-10-15 09:50:15 +02:00
Maarten L. Hekkelman
0e4b7063bb Use cifpp version that builds on windows 2024-10-15 09:12:32 +02:00
Maarten L. Hekkelman
2c09f1fb31 Version bump v4.4.9 2024-10-15 08:37:52 +02:00
Maarten L. Hekkelman
4517fe2bfc Merge branch 'develop' of github.com:PDB-REDO/dssp into develop 2024-10-07 11:30:26 +02:00
Maarten L. Hekkelman
05415c6a95 Fix writing version info 2024-10-07 11:29:28 +02:00
Maarten L. Hekkelman
34fff80687 better support for resource less building 2024-10-07 11:26:28 +02:00
Maarten L. Hekkelman
f30c6fa2bd Fix writing version info v4.4.8 2024-10-07 09:00:52 +02:00
Maarten L. Hekkelman
2830267a68 Merge pull request #88 from Augustin-Zidek/patch-1
Don't try to validate in annotateDSSP when the validator is not set
2024-09-26 13:37:23 +02:00
Augustin Zidek
3d835b8a85 Don't try to validate in annotateDSSP when the validator is not set (nullptr)
Fixes a segfault if one passes in a Cif datablock that didn't have `cif::pdb::reconstruct_pdbx(cif_file);` called on it.
2024-09-26 09:38:39 +01:00
Maarten L. Hekkelman
778d0ad54a catch this 2024-04-08 10:56:30 +02:00
Maarten L. Hekkelman
b51c8f0058 version string constant rename reverted 2024-04-08 10:50:47 +02:00
Maarten L. Hekkelman
abd9fdfac9 fix makefile 2024-04-08 10:33:17 +02:00
Maarten L. Hekkelman
57560472b4 Merge branch 'develop' into trunk v4.4.7 2024-03-30 21:27:53 +01:00
Maarten L. Hekkelman
bf823b8bae use system installed libraries by default 2024-03-30 21:20:10 +01:00