Nicolas Kruse
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cdf2533b26
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Merge pull request #11 from DLR-Institute-of-Future-Fuels/dev
Performance improvment by implementation of a custion solver, dropping the scipy dependency
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2025-11-26 15:30:29 +01:00 |
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Nicolas Kruse
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d3395488c7
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Updated optional scipy importing to pass type checking without scipy stubs
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2025-11-26 15:29:15 +01:00 |
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Nicolas Kruse
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a1485ff68d
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Updated the version of the CITATION.cff file
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2025-11-26 15:19:51 +01:00 |
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Nicolas Kruse
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82db3fc3b8
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version bumped to 1.1.4
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2025-11-26 15:10:06 +01:00 |
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Nicolas Kruse
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b465b91323
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Minor updates for tests and benchmarks as well as minor code style adjustments
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2025-11-26 15:08:40 +01:00 |
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Nicolas Kruse
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f8fb198b0b
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Improved performance by replacing root implementation of scipy by a custom one - optimized for the application. Benchmarks jumped from a few times slower than cantera to very slightly faster than cantera.
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2025-11-26 15:07:15 +01:00 |
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Nicolas Kruse
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6f8eb2914c
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extended the test_results_cantera
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2025-11-17 13:51:00 +01:00 |
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Nicolas Kruse
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681e356451
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replaced old "active_species" property in the examples by "species"
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2025-11-17 13:51:00 +01:00 |
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Nicolas Kruse
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9bdf350c17
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switched null_space implementation from scipy to using numpys svd
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2025-11-17 13:51:00 +01:00 |
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Nicolas
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7df98dda7b
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Zenodo DOI in citation.cff set
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2025-09-04 09:02:55 +02:00 |
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Nicolas
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21c6f3cb72
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SOC examples updated to use new slicing
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2025-09-03 15:57:55 +02:00 |
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Nicolas
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50b32bfa8f
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Numpy-like array slicing for fluids and elements added; get_n() function added for fluids and elements
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2025-09-03 15:57:55 +02:00 |
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Nicolas
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a04340dd7f
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Version changed to 1.1.3; config files updated
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2025-09-03 15:57:55 +02:00 |
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Nicolas
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fe0fd8ec21
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new lines at the ends of the benchmark scripts added
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2025-09-03 15:57:55 +02:00 |
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Nicolas
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b8baa14c84
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benchmark scripts added
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2025-09-03 15:57:55 +02:00 |
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Nicolas
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cc1057a99b
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CD for pypi: environment added
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2025-07-28 17:11:23 +02:00 |
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Nicolas
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e2a6541119
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Docs: Link to repo added
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2025-07-28 17:11:23 +02:00 |
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Nicolas
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dd86a1a83a
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doc path renamed to "api"
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2025-07-28 17:11:23 +02:00 |
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Nicolas Kruse
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38709c03ac
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md_to_code.py updated to handle print functions in the last line
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2025-07-28 15:06:32 +02:00 |
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Nicolas Kruse
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77b80a31fc
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sofc example fixes of the extension
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2025-07-28 15:06:32 +02:00 |
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Nicolas
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138e33e5b6
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sofc example extended
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2025-07-28 15:06:32 +02:00 |
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Nicolas
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14bd6605bc
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switched docs deployment method
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2025-07-28 15:06:32 +02:00 |
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Nicolas
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eb171fd424
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fix in SOEC example
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2025-07-28 15:06:32 +02:00 |
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Nicolas Kruse
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0e01d5e7be
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readme updated
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2025-07-21 11:39:51 +02:00 |
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Nicolas Kruse
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b277f91f5f
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example text improved
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2025-07-21 11:39:51 +02:00 |
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Nicolas Kruse
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c966aa74f3
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unified nomenclature in methane example
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2025-07-21 11:39:51 +02:00 |
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Nicolas
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f97c8a2697
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py.typed file added indication package uses type annotations
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2025-07-21 11:39:51 +02:00 |
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Nicolas Kruse
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10ade221e0
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fix in example description
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2025-07-21 11:39:51 +02:00 |
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Nicolas Kruse
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8627b59e0b
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comment lines in example removed
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2025-07-21 11:39:51 +02:00 |
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Nicolas Kruse
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73627613ac
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Example description fixed
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2025-07-03 15:11:17 +02:00 |
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Nicolas Kruse
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ac026600c5
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example added
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2025-07-03 15:11:17 +02:00 |
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Nicolas Kruse
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6f3ce50999
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figures in sulfur example improved
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2025-07-03 15:11:17 +02:00 |
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Nicolas Kruse
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e4b33b344b
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Minor README fixes
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2025-07-03 15:11:17 +02:00 |
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Nicolas Kruse
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7a4c705fe1
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carbon example extended
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2025-07-03 15:11:17 +02:00 |
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Nicolas Kruse
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e2e09a6ea4
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sofc example fixed and soec sample added
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2025-06-25 11:15:27 +02:00 |
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Nicolas Kruse
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df56d0ad37
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citation.cff acording to cffconvert is fixed; validation to ci added
CI: missing "jobs:" readded
CITATION.cff fixed and CI updated for CITATION.cff validation
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2025-06-24 16:37:43 +02:00 |
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Nicolas Kruse
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9a4c6351bb
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citation file updated
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2025-06-24 15:14:41 +02:00 |
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Nicolas Kruse
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5d5b8ec722
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codestyle for test fixed
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2025-06-24 15:14:41 +02:00 |
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Nicolas Kruse
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2bf7e21e73
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test with cantera reference updated
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2025-06-24 15:14:41 +02:00 |
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Nicolas Kruse
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762ff6929d
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test added for non-equilibrium cases
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2025-06-24 15:14:41 +02:00 |
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Nicolas Kruse
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0854d28e92
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Time hints added in main
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2025-06-24 15:14:41 +02:00 |
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Nicolas Kruse
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5172d3721e
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added weighting coefficient for better stability
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2025-06-24 15:14:41 +02:00 |
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Nicolas Kruse
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fe5bf70d83
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version changed to v1.1.2
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2025-06-24 15:14:41 +02:00 |
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Nicolas Kruse
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63b1808341
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Solver updated with start value estimation and log-error for elemental species balance
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2025-06-24 15:14:41 +02:00 |
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Nicolas Kruse
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a5f806aa31
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For equilibrium_eq start values are estimated now by calculating the maximum possible amount for each species based on the elements
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2025-06-24 15:14:41 +02:00 |
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Nicolas Kruse
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802aa68a25
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equilibrium solvers moved to separate file "_solver.py"
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2025-06-24 15:14:41 +02:00 |
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Nicolas Kruse
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973aedf058
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cff-version in CITATION.cff fixed
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2025-06-18 14:41:41 +02:00 |
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Nicolas Kruse
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d627b87df6
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added mypy conformity for numpy 2.3.0
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2025-06-18 14:18:46 +02:00 |
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Nicolas Kruse
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2f5cad3d05
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Docs and doc generation updated for the restructuring
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2025-06-18 08:48:51 +02:00 |
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Nicolas Kruse
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93f6d88cd4
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docstring fixed for species function
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2025-06-18 00:46:31 +02:00 |