Commit Graph

  • 526448b48e Increase the required cifpp version trunk Maarten L. Hekkelman 2026-05-18 13:06:17 +02:00
  • 525cf24ee2 Merge branch 'trunk' of github.com:PDB-REDO/dssp into trunk Maarten L. Hekkelman 2026-05-18 13:05:10 +02:00
  • a053e4d2d0 Increase the required cifpp version Maarten L. Hekkelman 2026-05-18 13:04:40 +02:00
  • 2c0520571a Write full ID in legacy output Maarten L. Hekkelman 2026-04-21 12:25:26 +02:00
  • 7eb2189187 shoot... Maarten L. Hekkelman 2026-04-14 13:15:19 +02:00
  • d8278f9f4f Version bump v4.6.1 Maarten L. Hekkelman 2026-04-14 12:28:11 +02:00
  • 473d0bd94c Merge branch 'develop' into trunk Maarten L. Hekkelman 2026-04-14 12:25:42 +02:00
  • 6db6788265 sigh.. develop Maarten L. Hekkelman 2026-04-14 12:17:11 +02:00
  • b1eba07925 I give up on trying to build the Python module in Github Actions Maarten L. Hekkelman 2026-04-14 12:07:05 +02:00
  • 5187ff7355 Add minimal components.cif Maarten L. Hekkelman 2026-04-14 11:50:24 +02:00
  • f5a2566b5d Fix output and tests Maarten L. Hekkelman 2026-04-14 11:28:41 +02:00
  • 40e6b4182c Merge branch 'develop' of github.com:PDB-REDO/dssp into develop Maarten L. Hekkelman 2026-04-14 09:56:04 +02:00
  • 63a561509b Increase required libcifpp version Maarten L. Hekkelman 2026-04-14 09:42:25 +02:00
  • 9b9f86544c github, take 5 Maarten L. Hekkelman 2026-04-13 13:44:02 +02:00
  • fc5d9bcade github, take 4 Maarten L. Hekkelman 2026-04-13 13:33:45 +02:00
  • 126a639437 github, take 3 Maarten L. Hekkelman 2026-04-13 13:31:00 +02:00
  • 35e56ce146 github, take 2 Maarten L. Hekkelman 2026-04-13 13:29:32 +02:00
  • 1aa2b2cb9c github, take 1 Maarten L. Hekkelman 2026-04-13 13:23:29 +02:00
  • 6949c9b2d6 Merge branch 'develop' of github.com:PDB-REDO/dssp into develop Maarten L. Hekkelman 2026-04-13 12:33:11 +02:00
  • 519c1d416e Support for new PDB ID's Maarten L. Hekkelman 2026-04-13 12:30:54 +02:00
  • 696b19b457 Support for new PDB ID's Maarten L. Hekkelman 2026-04-13 12:30:54 +02:00
  • 0050732202 Merge pull request #111 from PDB-REDO/mhekkel-patch-1 Maarten L. Hekkelman 2026-03-24 09:00:03 +01:00
  • 3a39335dff Bump DSSP version to 4.6 Maarten L. Hekkelman 2026-03-24 08:59:45 +01:00
  • 6de2d32c38 looking for a boost Maarten L. Hekkelman 2026-03-24 08:53:31 +01:00
  • f46b2cc180 it is fast_float, not fastfloat Maarten L. Hekkelman 2026-03-24 08:48:36 +01:00
  • e5bdcd230b And find boost Maarten L. Hekkelman 2026-03-24 08:47:16 +01:00
  • 40c29a3b0e Lets try boost again Maarten L. Hekkelman 2026-03-24 08:45:01 +01:00
  • e6123e5b86 needs fastfloat on macOS Maarten L. Hekkelman 2026-03-24 08:38:53 +01:00
  • 466e96aee6 nolint v4.6.0 Maarten L. Hekkelman 2026-03-24 08:35:25 +01:00
  • 57c6cb0aad version bump Maarten L. Hekkelman 2026-03-24 08:31:57 +01:00
  • 5e9fbd73c9 Merge branch 'develop' of github.com:PDB-REDO/dssp into develop Maarten L. Hekkelman 2026-03-23 11:29:53 +01:00
  • 5bfda300d8 Updated to work with libcifpp 10 Maarten L. Hekkelman 2026-03-23 11:27:11 +01:00
  • 820ec181d1 Updates for new libcifpp Maarten L. Hekkelman 2026-03-04 12:55:44 +01:00
  • 33f9b45ae5 Change for new libcifpp Maarten L. Hekkelman 2026-02-18 16:34:01 +01:00
  • a4182f880d Updated for libcifpp 10 Maarten L. Hekkelman 2026-02-17 14:23:39 +01:00
  • ffa9733b03 I give up Maarten L. Hekkelman 2026-01-31 15:52:50 +01:00
  • 1dbc5eea63 How about this Maarten L. Hekkelman 2026-01-31 14:29:08 +01:00
  • bdb9818a73 Let's try it another way Maarten L. Hekkelman 2026-01-31 14:22:09 +01:00
  • 2f997664c6 Find the correct python, please Maarten L. Hekkelman 2026-01-31 13:34:10 +01:00
  • 8172a136d6 aargh Maarten L. Hekkelman 2026-01-31 13:30:03 +01:00
  • bc99cb4aa5 without boost_root Maarten L. Hekkelman 2026-01-31 13:19:42 +01:00
  • 02bf0cbaaa looking for boost Maarten L. Hekkelman 2026-01-31 13:07:15 +01:00
  • d028c1f301 Simply require boost 1.86 or higher for python module Maarten L. Hekkelman 2026-01-31 13:02:41 +01:00
  • 1e67ba8c23 Use boost 1.90 on windows Maarten L. Hekkelman 2026-01-31 09:09:07 +01:00
  • ee80aad413 Version bump v4.5.8 Maarten L. Hekkelman 2026-01-28 17:19:03 +01:00
  • c4b000df87 Force building boost on windows Maarten L. Hekkelman 2026-01-27 16:07:18 +01:00
  • a7aecc3e41 Merge branch 'develop' of github.com:PDB-REDO/dssp into develop Maarten L. Hekkelman 2026-01-27 15:42:46 +01:00
  • 0d9e0fc27f Once more Maarten L. Hekkelman 2026-01-27 15:42:40 +01:00
  • b5239a06fb This one worked, on my old Windows machine Maarten L. Hekkelman 2026-01-27 15:30:53 +01:00
  • 7e1cc221ac update libcifpp version requirement Maarten L. Hekkelman 2026-01-27 14:39:17 +01:00
  • 30b2b27bdb For windows? part 2 Maarten L. Hekkelman 2026-01-27 14:09:55 +01:00
  • f2d55dce72 For windows? Maarten L. Hekkelman 2026-01-27 13:39:01 +01:00
  • ec416aedee macOS again Maarten L. Hekkelman 2026-01-27 13:37:45 +01:00
  • 977e34b092 Fix for testing python module on macOS Maarten L. Hekkelman 2026-01-27 13:31:38 +01:00
  • 1465c5276a boost, again? Maarten L. Hekkelman 2026-01-27 13:12:53 +01:00
  • 7f73ee534a Install boost Maarten L. Hekkelman 2026-01-27 13:02:03 +01:00
  • 9cc324c72d Fix makefile for tests Maarten L. Hekkelman 2026-01-27 12:56:28 +01:00
  • 86aef22c4f Work with both recent versions of libcifpp Maarten L. Hekkelman 2026-01-27 12:15:24 +01:00
  • 171ca99ad3 Require boost 1.84 or higher for numpy 2 Fix interface to be more compliant with standard concepts Maarten L. Hekkelman 2026-01-27 11:39:55 +01:00
  • ab92b66349 ouch Maarten L. Hekkelman 2025-11-27 16:19:02 +01:00
  • a382980d8a And again Maarten L. Hekkelman 2025-11-27 16:14:49 +01:00
  • a92752fff7 Try again Maarten L. Hekkelman 2025-11-27 16:09:55 +01:00
  • fe3ac968b3 Add CMAKE_INSTALL_PREFIX to CMake configuration Maarten L. Hekkelman 2025-11-27 15:57:07 +01:00
  • a6933af8f0 Modify libcifpp installation for OS-specific handling Maarten L. Hekkelman 2025-11-27 10:00:40 +01:00
  • d86232bb6d Build and install cifpp first, take 3 Maarten L. Hekkelman 2025-11-27 09:36:45 +01:00
  • 6ab8ac10bc specify config, will hopefully install libcifpp in windows Maarten L. Hekkelman 2025-11-27 09:32:04 +01:00
  • 085472dfde Build and install cifpp first, take 2 Maarten L. Hekkelman 2025-11-27 08:56:54 +01:00
  • 8423c32f1c Build and install cifpp first Maarten L. Hekkelman 2025-11-27 08:44:46 +01:00
  • 47fafe0d83 Merge branch 'trunk' into develop Maarten L. Hekkelman 2025-11-27 08:39:01 +01:00
  • d8dde6ef68 cifpp dependency changed Maarten L. Hekkelman 2025-11-27 08:38:56 +01:00
  • 0290cf7010 Merge branch 'develop' of github.com:PDB-REDO/dssp into develop Maarten L. Hekkelman 2025-11-27 08:38:29 +01:00
  • 371f17dd1b Updates for Debian repository, Version bump v4.5.7 Maarten L. Hekkelman 2025-11-26 10:53:56 +01:00
  • 2a0c54dc12 Merge pull request #101 from paretje/hotfix/add-pcre-to-dockerfile Maarten L. Hekkelman 2025-09-16 18:53:57 +02:00
  • babba2b0f9 add libpcre2 to Dockerfile Kevin Velghe 2025-09-16 16:53:27 +02:00
  • 97f77d616c update github actions v4.5.6 Maarten L. Hekkelman 2025-09-02 14:01:16 +02:00
  • 8597b7bd78 update github actions Maarten L. Hekkelman 2025-09-02 14:01:16 +02:00
  • 5b5e72784d Perhaps Catch2 3.4 is good enough? Maarten L. Hekkelman 2025-09-02 13:43:55 +02:00
  • 9d1eb5c514 boost-python for macOS github action Maarten L. Hekkelman 2025-09-02 13:39:50 +02:00
  • 7993b7dd70 Added PCRE2 for Windows github action Maarten L. Hekkelman 2025-09-02 13:37:29 +02:00
  • dd9f44576f use format from cif Maarten L. Hekkelman 2025-08-28 08:53:21 +02:00
  • 088fe148b8 use cif::format... sigh Maarten L. Hekkelman 2025-08-27 15:46:52 +02:00
  • c47466dad6 now using std::format Maarten L. Hekkelman 2025-08-27 11:36:52 +02:00
  • 5d7a9e8ead using fixup Maarten L. Hekkelman 2025-08-19 12:42:43 +02:00
  • 73e7cd9500 Regression, pdb::read needed more often v4.5.5 Maarten L. Hekkelman 2025-08-12 08:47:45 +02:00
  • 88d4dcc584 Version bump for develop branch, updated changelog Maarten L. Hekkelman 2025-08-04 13:53:31 +02:00
  • 33805a23b1 Clean up old DSSP info first before writing new Maarten L. Hekkelman 2025-08-04 13:46:54 +02:00
  • 527ffa1cf9 Attempt to make code more portable v4.5.4 Maarten L. Hekkelman 2025-08-04 12:36:25 +02:00
  • 8be2235ece Version bump, updated changelog Maarten L. Hekkelman 2025-08-04 11:50:51 +02:00
  • f1b1c0de7d Update tests Maarten L. Hekkelman 2025-08-04 11:39:41 +02:00
  • b4f86c0569 Reference info Maarten L. Hekkelman 2025-08-04 11:33:18 +02:00
  • f1e6dcf0f3 Fix install location for dictionaries when building cifpp Maarten L. Hekkelman 2025-08-04 10:49:44 +02:00
  • fceec2d162 Fix install location for dictionaries when building cifpp Maarten L. Hekkelman 2025-08-04 10:38:32 +02:00
  • 15bcddf030 work around cpmfindpackage limitation Maarten L. Hekkelman 2025-08-04 10:34:13 +02:00
  • 2e4f63c728 Merge branch 'trunk' into develop Maarten L. Hekkelman 2025-08-04 10:03:07 +02:00
  • f8dcf88db4 better error reporting while configuring Maarten L. Hekkelman 2025-08-04 10:02:57 +02:00
  • dab86753fd formatting Maarten L. Hekkelman 2025-06-11 10:38:41 +02:00
  • 593fa46e87 install dirs Maarten L. Hekkelman 2025-06-04 16:29:50 +02:00
  • 835418c181 using cpm Maarten L. Hekkelman 2025-06-04 16:13:59 +02:00
  • c6c66a1c91 better integration in pdb redo environment Maarten L. Hekkelman 2025-05-27 10:27:17 +02:00
  • 1a57b39782 remove debug statement Maarten L. Hekkelman 2025-05-16 16:05:48 +02:00