50 Commits

Author	SHA1	Message	Date
Maarten L. Hekkelman	f5a2566b5d	Fix output and tests	2026-04-14 11:28:41 +02:00
Maarten L. Hekkelman	40e6b4182c	Merge branch 'develop' of github.com:PDB-REDO/dssp into develop	2026-04-14 09:56:04 +02:00
Maarten L. Hekkelman	519c1d416e	Support for new PDB ID's	2026-04-13 12:32:51 +02:00
Maarten L. Hekkelman	57c6cb0aad	version bump	2026-03-24 08:31:57 +01:00
Maarten L. Hekkelman	5e9fbd73c9	Merge branch 'develop' of github.com:PDB-REDO/dssp into develop	2026-03-23 11:29:53 +01:00
Maarten L. Hekkelman	5bfda300d8	Updated to work with libcifpp 10	2026-03-23 11:27:11 +01:00
Maarten L. Hekkelman	820ec181d1	Updates for new libcifpp	2026-03-04 12:55:44 +01:00
Maarten L. Hekkelman	33f9b45ae5	Change for new libcifpp	2026-02-18 16:34:01 +01:00
Maarten L. Hekkelman	a4182f880d	Updated for libcifpp 10	2026-02-17 14:23:39 +01:00
Maarten L. Hekkelman	d028c1f301	Simply require boost 1.86 or higher for python module	2026-01-31 13:02:41 +01:00
Maarten L. Hekkelman	ee80aad413	Version bump	2026-01-28 17:19:03 +01:00
Maarten L. Hekkelman	86aef22c4f	Work with both recent versions of libcifpp	2026-01-27 12:15:24 +01:00
Maarten L. Hekkelman	171ca99ad3	Require boost 1.84 or higher for numpy 2 ... Fix interface to be more compliant with standard concepts	2026-01-27 11:39:55 +01:00
Maarten L. Hekkelman	371f17dd1b	Updates for Debian repository, Version bump	2025-11-26 10:53:56 +01:00
Maarten L. Hekkelman	dd9f44576f	use format from cif	2025-08-28 08:53:21 +02:00
Maarten L. Hekkelman	088fe148b8	use cif::format... sigh	2025-08-27 15:46:52 +02:00
Maarten L. Hekkelman	c47466dad6	now using std::format	2025-08-27 11:36:52 +02:00
Maarten L. Hekkelman	33805a23b1	Clean up old DSSP info first before writing new	2025-08-04 13:46:54 +02:00
Maarten L. Hekkelman	b4f86c0569	Reference info	2025-08-04 11:33:18 +02:00
Maarten L. Hekkelman	83f959fbe4	Merge branch 'develop' into trunk	2025-05-15 07:56:03 +02:00
Maarten L. Hekkelman	ff471530ce	Build and install python plugin	2025-05-14 13:56:30 +02:00
Maarten L. Hekkelman	dd9cd5e131	Small changes to interface for python-module	2025-05-14 11:57:33 +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	0c320d82e2	fix dictionary location	2025-05-12 14:40:53 +02:00
Maarten L. Hekkelman	86efff8ada	updates for audit_conform	2025-05-12 12:07:09 +02:00
Maarten L. Hekkelman	ec1ded8087	Version bump	2025-04-09 09:56:01 +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	c57c39706f	Fixes required for new libcifpp 8	2025-04-02 13:48:05 +02:00
Maarten L. Hekkelman	3cbec3abea	Add dictionary to audit_conform	2025-02-26 09:16:36 +01:00
Maarten L. Hekkelman	4bee8e336d	Fix dssp extension dictionary	2025-01-15 12:31:55 +01:00
Maarten L. Hekkelman	f30c6fa2bd	Fix writing version info	2024-10-07 09:00:52 +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	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	30121f66b0	Merge branch 'develop' of github.com:PDB-REDO/dssp into develop	2024-03-13 16:03:29 +01:00
Maarten L. Hekkelman	a6281bc087	Merge branch 'trunk' into develop	2024-03-13 16:02:35 +01:00
Maarten L. Hekkelman	068b315ea1	makefile updates	2024-03-13 15:57:05 +01:00
Maarten L. Hekkelman	6e497de754	Final touches	2024-03-09 19:05:29 +01:00
Maarten L. Hekkelman	946905a6c8	for windows?	2024-03-09 11:28:31 +01:00
Maarten L. Hekkelman	25c90ab2b1	stand alone build with fetch content and new cifpp	2024-03-09 10:42:42 +01:00
Maarten L. Hekkelman	1c7ce86928	Update libcifpp dependency	2024-01-23 12:46:50 +01:00
Maarten L. Hekkelman	59fe8b39cc	fix include for new libcifpp	2024-01-04 13:08:25 +01:00
Maarten L. Hekkelman	cded8443de	update for WIN32	2023-11-02 14:11:59 +01:00
Maarten L. Hekkelman	ad317afe38	keep version numbers in sync!	2023-10-20 16:13:56 +02:00
Maarten L. Hekkelman	ac1d2eff12	clean up	2023-09-14 09:59:25 +02:00
Maarten L. Hekkelman	9cc5c13ab4	pdb routines have moved in libcifpp	2023-09-13 10:20:34 +02:00
Maarten L. Hekkelman	b0af4c9032	version bump on lib	2023-08-15 13:30:03 +02:00
Maarten L. Hekkelman	dd8a9c3cd1	refactored into a lib and an executable	2023-08-15 10:30:15 +02:00