Jim Procter [Thu, 23 May 2024 19:34:09 +0000 (20:34 +0100)]
JAL-1551 formatting
Jim Procter [Thu, 23 May 2024 19:33:23 +0000 (20:33 +0100)]
JAL-4159 first stab at injecting blosum62 similarity scores rather than alignment scores - still need to condition similarity score matrix in the same way as is done for pairwise alignments using AlignSeq.scoreAlignment
Jim Procter [Thu, 23 May 2024 17:23:50 +0000 (18:23 +0100)]
JAL-4423 provide option in calc dialog to re-use the existing MSA rather than compute pairwise alignments for pasimap
Jim Procter [Thu, 23 May 2024 17:18:39 +0000 (18:18 +0100)]
JAL-4159 fix sense of console/alignment output suppression flags and make sure all output is suppressed when computing pairwise alignments
Jim Procter [Thu, 23 May 2024 17:17:12 +0000 (18:17 +0100)]
JAL-4159 disable the score model combo box when pasimap is selected
MorellThomas [Thu, 23 May 2024 08:19:42 +0000 (10:19 +0200)]
Fix PaSiMap not having the eigenvalues saved
MorellThomas [Wed, 22 May 2024 13:53:35 +0000 (15:53 +0200)]
revert build.gradle changes
MorellThomas [Wed, 22 May 2024 13:46:48 +0000 (15:46 +0200)]
Save PaSiMap with Jalview Session
MorellThomas [Wed, 22 May 2024 11:36:07 +0000 (13:36 +0200)]
Rectanuglar selection changed to Mouse Button 3 drag
Jim Procter [Tue, 21 May 2024 17:29:24 +0000 (18:29 +0100)]
JAL-4259 set title using original alignment window's title
Jim Procter [Tue, 21 May 2024 17:21:05 +0000 (18:21 +0100)]
JAL-4159 implement bounds for PASIMAP calculation - from 9 to 20000 sequences.
Jim Procter [Tue, 21 May 2024 17:18:20 +0000 (18:18 +0100)]
JAL-4159 connectivity should be computed for the sequences analysed with PAsiMap, not the alignment
Jim Procter [Tue, 21 May 2024 17:16:59 +0000 (18:16 +0100)]
JAL-4159 PASiMap currently doesn't support different score models
Jim Procter [Tue, 21 May 2024 17:15:11 +0000 (18:15 +0100)]
JAL-4159 sometimes the progress bar may not be available - null check
Jim Procter [Tue, 21 May 2024 14:46:05 +0000 (15:46 +0100)]
Merge branch 'feature/JAL-4159_pasimap' into spike/JAL-4159_pasimap_2113_series
loop in new progress bar and resolve formatting conflicts in PairwiseAlignPanel
Jim Procter [Thu, 16 May 2024 07:07:17 +0000 (08:07 +0100)]
Merge branch 'develop' into feature/JAL-4159_pasimap
doesn't seem to have apache-math present
Conflicts:
build.gradle
Jim Procter [Thu, 16 May 2024 06:54:13 +0000 (07:54 +0100)]
Merge branch 'feature/JAL-4386_calculate_tree_using_secondary_structure_annotation' into develop
Jim Procter [Thu, 16 May 2024 06:53:50 +0000 (07:53 +0100)]
Merge branch 'develop' into feature/JAL-4386_calculate_tree_using_secondary_structure_annotation
Jim Procter [Thu, 16 May 2024 06:52:10 +0000 (07:52 +0100)]
JAL-4356 bump release date to today, release notes for patching JAL-4407 and known issue report for JAL-3124 and JAL-4415
Renia Correya [Wed, 15 May 2024 16:30:44 +0000 (17:30 +0100)]
JAL-4386 Fixed failed test case
Jim Procter [Wed, 15 May 2024 16:15:05 +0000 (17:15 +0100)]
Merge branch 'bug/JAL-4416_sview_not_shown_for_local_strucfile' into develop
Renia Correya [Wed, 15 May 2024 15:56:22 +0000 (16:56 +0100)]
JAL-4386 Fixed failed test cases
Jim Procter [Wed, 15 May 2024 15:54:47 +0000 (16:54 +0100)]
JAL-4416 TODO for fixing JAL-4415 JAL-3124 - need a test for this
Jim Procter [Wed, 15 May 2024 15:53:18 +0000 (16:53 +0100)]
JAL-4416 ensure the structure view is shown and any added annotation is displayed
Jim Procter [Wed, 15 May 2024 15:44:23 +0000 (16:44 +0100)]
JAL-4416 make sure the structure viewer is actually opened when handling local file view
Renia Correya [Wed, 15 May 2024 15:37:39 +0000 (16:37 +0100)]
JAL-4386 Added preferences for secondary structure consensus and it is
set as false by default to skip failed test cases.
Jim Procter [Wed, 15 May 2024 13:28:59 +0000 (14:28 +0100)]
Merge branch 'bug/JAL-4407_no_sec_str_from_draganddrop_to_msa' into develop
Renia Correya [Wed, 15 May 2024 09:58:52 +0000 (10:58 +0100)]
JAL-4386 - Implementation of retrieving secondary structure
source/provider from matching the annotation description and PDB entry.
Implementation of Show secondary structure menu option. Updated
calculation of secondary structure consensus.
Ben Soares [Tue, 14 May 2024 16:38:54 +0000 (17:38 +0100)]
JAL-4217 Upped the main testTask0 timeout to 15 minutes for build server's benefit
Jim Procter [Tue, 14 May 2024 13:41:03 +0000 (14:41 +0100)]
JAL-4356 fix release note
Jim Procter [Tue, 14 May 2024 13:26:49 +0000 (14:26 +0100)]
JAL-4356 set release date to Weds 15th May and update release notes
Jim Procter [Mon, 13 May 2024 16:22:06 +0000 (17:22 +0100)]
JAL-4356 JAL-518 JAL-4413 release notes
Jim Procter [Mon, 13 May 2024 16:14:08 +0000 (17:14 +0100)]
Merge branch 'features/JAL-518_justify_seqs_in_region' into develop
Jim Procter [Mon, 13 May 2024 16:05:11 +0000 (17:05 +0100)]
JAL-518 better test coverage and support for case preservation
Jim Procter [Mon, 13 May 2024 15:01:36 +0000 (16:01 +0100)]
JAL-518 failing test for case preservation on justify
Renia Correya [Mon, 13 May 2024 14:30:06 +0000 (15:30 +0100)]
Merge remote-tracking branch 'origin/develop' into feature/JAL-4386_calculate_tree_using_secondary_structure_annotation
Jim Procter [Mon, 13 May 2024 14:10:03 +0000 (15:10 +0100)]
Merge branch 'develop' into features/JAL-518_justify_seqs_in_region
Jim Procter [Mon, 13 May 2024 14:03:52 +0000 (15:03 +0100)]
JAL-4413 timeouts Merge branch 'improvement/JAL-4217_added_a_timeout_to_tests' into develop
Jim Procter [Mon, 13 May 2024 12:44:27 +0000 (13:44 +0100)]
Merge branch 'develop' into features/JAL-518_justify_seqs_in_region
Conflicts:
src/jalview/api/AlignViewControllerI.java
src/jalview/api/AlignViewportI.java
src/jalview/controller/AlignViewController.java
Renia Correya [Mon, 13 May 2024 09:43:44 +0000 (10:43 +0100)]
Merge branch 'feature/JAL-4386_calculate_tree_using_secondary_structure_annotation' of https://source.jalview.org/git/jalview.git into feature/JAL-4386_calculate_tree_using_secondary_structure_annotation
Renia Correya [Mon, 13 May 2024 09:23:02 +0000 (10:23 +0100)]
JAL-4386 - Implementation of substitution matrix and test cases.
Jim Procter [Fri, 10 May 2024 14:52:00 +0000 (15:52 +0100)]
JAL-4411 fix typo :(
Jim Procter [Fri, 10 May 2024 14:50:55 +0000 (15:50 +0100)]
JAL-4411 store class of provider in PDBEntry
Ben Soares [Thu, 2 May 2024 18:48:41 +0000 (19:48 +0100)]
JAL-4217 Sensible timeout for testTask0
Ben Soares [Thu, 2 May 2024 18:29:43 +0000 (19:29 +0100)]
JAL-4217 Added a timeout for testTasks. If timeout is exceeded then test execution should be interrupted.
Renia Correya [Wed, 1 May 2024 16:47:36 +0000 (17:47 +0100)]
Merge remote-tracking branch 'origin/bug/JAL-4407_no_sec_str_from_draganddrop_to_msa' into feature/JAL-4386_calculate_tree_using_secondary_structure_annotation
Jim Procter [Wed, 1 May 2024 15:15:15 +0000 (16:15 +0100)]
JAL-4407 don't transfer 'local' settings - leave as default 3d-structure annotation processing
Jim Procter [Wed, 1 May 2024 14:58:21 +0000 (15:58 +0100)]
JAL-4407 failing test checking for secondary structure is added when calling the associate pdb file routine
Renia Correya [Tue, 30 Apr 2024 14:37:13 +0000 (15:37 +0100)]
JAL-4392 Merging consensus secondary structure
Renia Correya [Tue, 30 Apr 2024 14:34:18 +0000 (15:34 +0100)]
JAL-4386 Comparing secondary structure similarity directly with a basic
substitution matrix. Some code refactoring.
Renia Correya [Fri, 26 Apr 2024 09:27:28 +0000 (10:27 +0100)]
JAL-4386 Drop down for secondary structure sources in calculate window
Renia Correya [Wed, 24 Apr 2024 14:26:35 +0000 (15:26 +0100)]
JAL-4386 PCA/Tree Calculation for Secondary Structures: Changes related to dropdown in Calculate window.
MorellThomas [Thu, 18 Apr 2024 12:16:08 +0000 (14:16 +0200)]
Merge branch 'test/progressBar' into feature/JAL-4159_pasimap
MorellThomas [Thu, 18 Apr 2024 12:13:43 +0000 (14:13 +0200)]
Implemented ProgressBar for PaSiMap
Renia Correya [Tue, 16 Apr 2024 16:28:21 +0000 (17:28 +0100)]
JAL-4386 Calculate tree using secondary structure annotation - Documentation, Changes to include Secondary structure from JPred.
MorellThomas [Fri, 12 Apr 2024 08:03:52 +0000 (10:03 +0200)]
inlcude progress
James Procter [Tue, 9 Apr 2024 07:03:45 +0000 (08:03 +0100)]
JAL-4159 recover 2.11.3 series gradle/build.properties so we can build the spike
James Procter [Tue, 9 Apr 2024 07:00:04 +0000 (08:00 +0100)]
JAL-4390 don't output alignment to text panel and stdout when lots of sequences processed by pairwise alignemnt panel
MorellThomas [Fri, 15 Mar 2024 09:25:36 +0000 (10:25 +0100)]
Fix output of all dimensions
MorellThomas [Fri, 15 Mar 2024 06:54:42 +0000 (07:54 +0100)]
Alogirthm working, but still giving slightly off results
Renia Correya [Wed, 13 Mar 2024 11:50:16 +0000 (11:50 +0000)]
JAL-4386_Added changes in similarity score calculation for different cases of sequences with undefined secondary structure
Renia Correya [Fri, 8 Mar 2024 14:49:48 +0000 (14:49 +0000)]
JAL-4386 Corrected failed test case.
Renia Correya [Fri, 8 Mar 2024 14:31:51 +0000 (14:31 +0000)]
JAL-4386 Added further checks for sequences that have no secondary structure.
Renia Correya [Fri, 8 Mar 2024 09:16:44 +0000 (09:16 +0000)]
JAL-4386 Calculate tree using secondary structure annotation
MorellThomas [Thu, 7 Mar 2024 09:00:38 +0000 (10:00 +0100)]
Inlcude 8 dimensions
MorellThomas [Wed, 6 Mar 2024 14:29:15 +0000 (15:29 +0100)]
Fix PaSiMap on selected sequences
MorellThomas [Wed, 6 Mar 2024 13:55:18 +0000 (14:55 +0100)]
Test version to switch branches
MorellThomas [Wed, 31 Jan 2024 08:09:20 +0000 (09:09 +0100)]
Fix output points column labels
James Procter [Tue, 23 Jan 2024 17:27:24 +0000 (17:27 +0000)]
JAL-4356 release notes
James Procter [Tue, 23 Jan 2024 17:08:28 +0000 (17:08 +0000)]
JAL-4356 update release notes for 2.11.3.3
James Procter [Tue, 23 Jan 2024 16:51:04 +0000 (16:51 +0000)]
Merge branch 'bug/JAL-4290_headless_alignment_export_with_structure_annotations_doesnt_include_secondary_structure_and_temperature_factor' into develop
James Procter [Tue, 23 Jan 2024 14:21:59 +0000 (14:21 +0000)]
Merge branch 'develop' into bug/JAL-4290_headless_alignment_export_with_structure_annotations_doesnt_include_secondary_structure_and_temperature_factor
Ben Soares [Wed, 20 Dec 2023 13:23:07 +0000 (13:23 +0000)]
JAL-4367 Limit right and top adjustments
Ben Soares [Wed, 20 Dec 2023 13:14:26 +0000 (13:14 +0000)]
JAL-4290 Fix image comparison between gui and headless output. Images are now the same
Ben Soares [Wed, 20 Dec 2023 00:08:56 +0000 (00:08 +0000)]
JAL-4290 fixed tests
Ben Soares [Tue, 19 Dec 2023 17:52:45 +0000 (17:52 +0000)]
Merge branch 'bug/JAL-4353_cannot_output_multiple_different_structure_images_for_one_alignment' into bug/JAL-4290_headless_alignment_export_with_structure_annotations_doesnt_include_secondary_structure_and_temperature_factor
Ben Soares [Thu, 14 Dec 2023 15:40:48 +0000 (15:40 +0000)]
Merge branch 'develop' into bug/JAL-4353_cannot_output_multiple_different_structure_images_for_one_alignment
James Procter [Tue, 12 Dec 2023 20:55:49 +0000 (20:55 +0000)]
Merge branch 'bug/JAL-4353_cannot_output_multiple_different_structure_images_for_one_alignment_with_renderpatch' into bug/JAL-4353_cannot_output_multiple_different_structure_images_for_one_alignment
James Procter [Tue, 12 Dec 2023 17:20:04 +0000 (17:20 +0000)]
JAL-4353 wait for files to be written fully before comparing size with older file
James Procter [Tue, 12 Dec 2023 17:18:48 +0000 (17:18 +0000)]
JAL-4353 singleThread all tests
James Procter [Wed, 10 Jan 2024 15:51:52 +0000 (15:51 +0000)]
JAL-4369 invokeAndWait to avoid hang whilst calling getFiles if a Jmol redraw is in progress
James Procter [Wed, 10 Jan 2024 10:26:26 +0000 (10:26 +0000)]
JAL-4369 uniprotkb - try to avoid another redirect response
James Procter [Tue, 9 Jan 2024 18:36:12 +0000 (18:36 +0000)]
JAL-4369 use rest.uniprot.org as fetch domain
t pu# Please enter the commit message for your changes. Lines starting
James Procter [Tue, 23 Jan 2024 13:39:04 +0000 (13:39 +0000)]
Merge branch 'bug/JAL-4373_jvmmemmax_and_jvmmempc_ignored_on_command_line_for_executable_jar_launch' into develop
James Procter [Tue, 23 Jan 2024 13:34:35 +0000 (13:34 +0000)]
Merge branch 'bug/JAL-4368_default_colourscheme_applied_to_JVP_inappropriately' into develop
Ben Soares [Fri, 19 Jan 2024 17:00:46 +0000 (17:00 +0000)]
JAL-4373 Setting the jvmmempc and jvmmemmax strings from the Arg.getName() for consistency. Updated some comments.
Ben Soares [Fri, 19 Jan 2024 16:11:14 +0000 (16:11 +0000)]
JAL-4373 Fix Main-Class and other attribute settings in the shadowJar manifest. It requires a 'dummy' Jar task with the correct settings.
MorellThomas [Wed, 10 Jan 2024 09:35:05 +0000 (10:35 +0100)]
Fixed PaSiMap output columns
Ben Soares [Fri, 5 Jan 2024 17:28:36 +0000 (17:28 +0000)]
JAL-4368 Only set a colour scheme if --colour is given or it's not a JVP file
Ben Soares [Tue, 19 Dec 2023 17:50:33 +0000 (17:50 +0000)]
JAL-4290 Fixed one test
Ben Soares [Mon, 18 Dec 2023 13:58:28 +0000 (13:58 +0000)]
JAL-4290 not quite working tests
Ben Soares [Mon, 18 Dec 2023 13:58:15 +0000 (13:58 +0000)]
JAL-4290 incorrect usage of main()
Ben Soares [Fri, 15 Dec 2023 21:30:13 +0000 (21:30 +0000)]
Merge branch 'bug/JAL-4290_headless_alignment_export_with_structure_annotations_doesnt_include_secondary_structure_and_temperature_factor' of https://source.jalview.org/git/jalview into bug/JAL-4290_headless_alignment_export_with_structure_annotations_doesnt_include_secondary_structure_and_temperature_factor
Ben Soares [Fri, 15 Dec 2023 21:29:59 +0000 (21:29 +0000)]
JAL-4290 Add method to allow for specific settings. Revert setting show annotations.
Ben Soares [Fri, 15 Dec 2023 15:18:23 +0000 (15:18 +0000)]
JAL-4290 Set structureSelectionManager settings more generically and when no desktop exists
James Procter [Fri, 15 Dec 2023 11:31:30 +0000 (11:31 +0000)]
Merge branch 'bug/JAL-4290_headless_alignment_figure_with_sse' into bug/JAL-4290_headless_alignment_export_with_structure_annotations_doesnt_include_secondary_structure_and_temperature_factor
James Procter [Fri, 15 Dec 2023 11:30:11 +0000 (11:30 +0000)]
JAL-4290 new CommandsTest.headlessOrGuiImageOutputTest - uses CommandLineOperations.Worker to run jalview as a separate process to verify headless alignment image export should be same size as when launched with —gui
Ben Soares [Fri, 15 Dec 2023 01:08:11 +0000 (01:08 +0000)]
JAL-4290 Move some annotation visibility settings to after opening a structure. Set synchronously if in headless mode.
James Procter [Thu, 14 Dec 2023 15:39:20 +0000 (15:39 +0000)]
JAL-4356 update release notes
James Procter [Thu, 14 Dec 2023 15:28:08 +0000 (15:28 +0000)]
Merge branch 'bug/JAL-4353_cannot_output_multiple_different_structure_images_for_one_alignment' into develop