summary refs log tree commit diff
path: root/gnu/packages/python-science.scm
blob: d2c4caac3a143e1fa001114eaaf9e2dc9cd37e2b (plain) (blame)
1
2
3
4
5
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
21
22
23
24
25
26
27
28
29
30
31
32
33
34
35
36
37
38
39
40
41
42
43
44
45
46
47
48
49
50
51
52
53
54
55
56
57
58
59
60
61
62
63
64
65
66
67
68
69
70
71
72
73
74
75
76
77
78
79
80
81
82
83
84
85
86
87
88
89
90
91
92
93
94
95
96
97
98
99
100
101
102
103
104
105
106
107
108
109
110
111
112
113
114
115
116
117
118
119
120
121
122
123
124
125
126
127
128
129
130
131
132
133
134
135
136
137
138
139
140
141
142
143
144
145
146
147
148
149
150
151
152
153
154
155
156
157
158
159
160
161
162
163
164
165
166
167
168
169
170
171
172
173
174
175
176
177
178
179
180
181
182
183
184
185
186
187
188
189
190
191
192
193
194
195
196
197
198
199
200
201
202
203
204
205
206
207
208
209
210
211
212
213
214
215
216
217
218
219
220
221
222
223
224
225
226
227
228
229
230
231
232
233
234
235
236
237
238
239
240
241
242
243
244
245
246
247
248
249
250
251
252
253
254
255
256
257
258
259
260
261
262
263
264
265
266
267
268
269
270
271
272
273
274
275
276
277
278
279
280
281
282
283
284
285
286
287
288
289
290
291
292
293
294
295
296
297
298
299
300
301
302
303
304
305
306
307
308
309
310
311
312
313
314
315
316
317
318
319
320
321
322
323
324
325
326
327
328
329
330
331
332
333
334
335
336
337
338
339
340
341
342
343
344
345
346
347
348
349
350
351
352
353
354
355
356
357
358
359
360
361
362
363
364
365
366
367
368
369
370
371
372
373
374
375
376
377
378
379
380
381
382
383
384
385
386
387
388
389
390
391
392
393
394
395
396
397
398
399
400
401
402
403
404
405
406
407
408
409
410
411
412
413
414
415
416
417
418
419
420
421
422
423
424
425
426
427
428
429
430
431
432
433
434
435
436
437
438
439
440
441
442
443
444
445
446
447
448
449
450
451
452
453
454
455
456
457
458
459
460
461
462
463
464
465
466
467
468
469
470
471
472
473
474
475
476
477
478
479
480
481
482
483
484
485
486
487
488
489
490
491
492
493
494
495
496
497
498
499
500
501
502
503
504
505
506
507
508
509
510
511
512
513
514
515
516
517
518
519
520
521
522
523
524
525
526
527
528
529
530
531
532
533
534
535
536
537
538
539
540
541
542
543
544
545
546
547
548
549
550
551
552
553
554
555
556
557
558
559
560
561
562
563
564
565
566
567
568
569
570
571
572
573
574
575
576
577
578
579
580
581
582
583
584
585
586
587
588
589
590
591
592
593
594
595
596
597
598
599
600
601
602
603
604
605
606
607
608
609
610
611
612
613
614
615
616
617
618
619
620
621
622
623
624
625
626
627
628
629
630
631
632
633
634
635
636
637
638
639
640
641
642
643
644
645
646
647
648
649
650
651
652
653
654
655
656
657
658
659
660
661
662
663
664
665
666
667
668
669
670
671
672
673
674
675
676
677
678
679
680
681
682
683
684
685
686
687
688
689
690
691
692
693
694
695
696
697
698
699
700
701
702
703
704
705
706
707
708
709
710
711
712
713
714
715
716
717
718
719
720
721
722
723
724
725
726
727
728
729
730
731
732
733
734
735
;;; GNU Guix --- Functional package management for GNU
;;; Copyright © 2015, 2016, 2020, 2021 Ricardo Wurmus <rekado@elephly.net>
;;; Copyright © 2015 Federico Beffa <beffa@fbengineering.ch>
;;; Copyright © 2016 Ben Woodcroft <donttrustben@gmail.com>
;;; Copyright © 2016 Hartmut Goebel <h.goebel@crazy-compilers.com>
;;; Copyright © 2016 Efraim Flashner <efraim@flashner.co.il>
;;; Copyright © 2016, 2017, 2018, 2019, 2020 Marius Bakke <mbakke@fastmail.com>
;;; Copyright © 2019 Tobias Geerinckx-Rice <me@tobias.gr>
;;; Copyright © 2019 Maxim Cournoyer <maxim.cournoyer@gmail.com>
;;; Copyright © 2019 Giacomo Leidi <goodoldpaul@autistici.org>
;;; Copyright © 2020 Pierre Langlois <pierre.langlois@gmx.com>
;;; Copyright © 2020, 2021 Vinicius Monego <monego@posteo.net>
;;; Copyright © 2021 Greg Hogan <code@greghogan.com>
;;; Copyright © 2021 Roel Janssen <roel@gnu.org>
;;; Copyright © 2021 Paul Garlick <pgarlick@tourbillion-technology.com>
;;;
;;; This file is part of GNU Guix.
;;;
;;; GNU Guix is free software; you can redistribute it and/or modify it
;;; under the terms of the GNU General Public License as published by
;;; the Free Software Foundation; either version 3 of the License, or (at
;;; your option) any later version.
;;;
;;; GNU Guix is distributed in the hope that it will be useful, but
;;; WITHOUT ANY WARRANTY; without even the implied warranty of
;;; MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE.  See the
;;; GNU General Public License for more details.
;;;
;;; You should have received a copy of the GNU General Public License
;;; along with GNU Guix.  If not, see <http://www.gnu.org/licenses/>.

(define-module (gnu packages python-science)
  #:use-module ((guix licenses) #:prefix license:)
  #:use-module (gnu packages)
  #:use-module (gnu packages base)
  #:use-module (gnu packages check)
  #:use-module (gnu packages gcc)
  #:use-module (gnu packages image-processing)
  #:use-module (gnu packages maths)
  #:use-module (gnu packages mpi)
  #:use-module (gnu packages perl)
  #:use-module (gnu packages pkg-config)
  #:use-module (gnu packages python)
  #:use-module (gnu packages python-build)
  #:use-module (gnu packages python-check)
  #:use-module (gnu packages python-web)
  #:use-module (gnu packages python-xyz)
  #:use-module (gnu packages simulation)
  #:use-module (gnu packages sphinx)
  #:use-module (gnu packages time)
  #:use-module (gnu packages xdisorg)
  #:use-module (gnu packages xml)
  #:use-module (gnu packages xorg)
  #:use-module (guix packages)
  #:use-module (guix download)
  #:use-module (guix git-download)
  #:use-module (guix utils)
  #:use-module (guix build-system python))

(define-public python-scipy
  (package
    (name "python-scipy")
    (version "1.6.0")
    (source
     (origin
       (method url-fetch)
       (uri (pypi-uri "scipy" version))
       (sha256
        (base32 "0rh5b1rwdcvvagld8vpxnpaibszy1skpx39a0fwzd5gx5pwcjvfb"))))
    (build-system python-build-system)
    (propagated-inputs
     `(("python-numpy" ,python-numpy)
       ("python-matplotlib" ,python-matplotlib)
       ("python-pyparsing" ,python-pyparsing)))
    (inputs
     `(("openblas" ,openblas)
       ("pybind11" ,pybind11)))
    (native-inputs
     `(("python-cython" ,python-cython)
       ("python-pytest" ,python-pytest)
       ("python-sphinx" ,python-sphinx)
       ("python-numpydoc" ,python-numpydoc)
       ("gfortran" ,gfortran)
       ("perl" ,perl)
       ("which" ,which)))
    (outputs '("out" "doc"))
    (arguments
     `(#:phases
       (modify-phases %standard-phases
         (add-before 'build 'change-home-dir
           (lambda _
             ;; Change from /homeless-shelter to /tmp for write permission.
             (setenv "HOME" "/tmp")
             #t))
         (add-after 'unpack 'disable-broken-tests
           (lambda _
             (substitute* "scipy/sparse/linalg/dsolve/tests/test_linsolve.py"
               (("^( +)def test_threads_parallel\\(self\\):" m indent)
                (string-append indent
                               "@pytest.mark.skip(reason=\"Disabled by Guix\")\n"
                               m)))
             (substitute* "scipy/sparse/linalg/eigen/arpack/tests/test_arpack.py"
               (("^def test_parallel_threads\\(\\):" m)
                (string-append "@pytest.mark.skip(reason=\"Disabled by Guix\")\n"
                               m)))
             #t))
         (add-before 'build 'configure-openblas
           (lambda* (#:key inputs #:allow-other-keys)
             (call-with-output-file "site.cfg"
               (lambda (port)
                 (format port
                         "[blas]
libraries = openblas
library_dirs = ~a/lib
include_dirs = ~a/include

# backslash-n to make emacs happy
\n[atlas]
library_dirs = ~a/lib
atlas_libs = openblas
"
                         (assoc-ref inputs "openblas")
                         (assoc-ref inputs "openblas")
                         (assoc-ref inputs "openblas"))))
             #t))
         (add-after 'install 'install-doc
           (lambda* (#:key inputs outputs #:allow-other-keys)
             (let* ((data (string-append (assoc-ref outputs "doc") "/share"))
                    (doc (string-append data "/doc/" ,name "-" ,version))
                    (html (string-append doc "/html"))
                    (pyver ,(string-append "PYVER=" (version-major+minor
                                                     (package-version python))))
                    ;; By default it tries to run sphinx-build through the Python
                    ;; interpreter which won't work with our shell wrapper.
                    (sphinxbuild "SPHINXBUILD=LANG=C sphinx-build"))
               ;; Make installed package available for building the
               ;; documentation
               (add-installed-pythonpath inputs outputs)
               (with-directory-excursion "doc"
                 ;; Fix generation of images for mathematical expressions.
                 (substitute* (find-files "source" "conf\\.py")
                   (("pngmath_use_preview = True")
                    "pngmath_use_preview = False"))
                 (mkdir-p html)
                 (invoke "make" "html" pyver sphinxbuild)
                 (with-directory-excursion "build/html"
                   (for-each (lambda (file)
                               (let* ((dir (dirname file))
                                      (tgt-dir (string-append html "/" dir)))
                                 (install-file file html)))
                             (find-files "." ".*")))))
             #t))
         ;; Tests can only be run after the library has been installed and not
         ;; within the source directory.
         (delete 'check)
         (add-after 'install 'check
           (lambda* (#:key inputs outputs #:allow-other-keys)
             (add-installed-pythonpath inputs outputs)
             (with-directory-excursion "/tmp"
               (invoke "python" "-c"
                       "import scipy; scipy.test(verbose=2)")))))))
    (home-page "https://www.scipy.org/")
    (synopsis "The Scipy library provides efficient numerical routines")
    (description "The SciPy library is one of the core packages that make up
the SciPy stack.  It provides many user-friendly and efficient numerical
routines such as routines for numerical integration and optimization.")
    (properties `((python2-variant . ,(delay python2-scipy))))
    (license license:bsd-3)))

;; Version 1.2.2 is the last version to support Python 2
(define-public python2-scipy
  (package
    (inherit (package-with-python2
              (strip-python2-variant python-scipy)))
    (version "1.2.2")
    (source
     (origin
       (method url-fetch)
       (uri (pypi-uri "scipy" version))
       (sha256
        (base32
         "1cgvgin8fvckv96hjh3ikmwkra5rif51bdb75ifzf7xbil5iwcx4"))))))

(define-public python2-weave
  (package
    (name "python2-weave")
    (version "0.16.0")
    (source
     (origin
       (method url-fetch)
       (uri (pypi-uri "weave" version))
       (sha256
        (base32 "0jnm3584mfichgwgrd1gk5i42ll9c08nkw9716n947n4338f6ghs"))))
    (build-system python-build-system)
    (arguments
     `(#:python ,python-2
       #:phases
       (modify-phases %standard-phases
         (replace 'check
           (lambda _
             (invoke "nosetests" "-v"
                     "--exclude"
                     "test_(user|incorrect_ownership|char_fail|obj_fail)"))))))
    (propagated-inputs
     `(("python-numpy" ,python2-numpy)))
    (native-inputs
     `(("python-nose" ,python2-nose)))
    (home-page "https://www.scipy.org/")
    (synopsis "Tools for including C/C++ code within Python code")
    (description "Weave is the stand-alone version of the obsolete Scipy
submodule @code{scipy.weave}.  It is Python 2.x only, and is provided for
users that need new versions of Scipy but have existing code that still
depends on @code{scipy.weave}.  For new code, users are recommended to use
Cython.")
    (license license:bsd-3)))

(define-public python-scikit-fuzzy
  (package
    (name "python-scikit-fuzzy")
    (version "0.4.2")
    (source
     (origin
       (method url-fetch)
       (uri (pypi-uri "scikit-fuzzy" version))
       (sha256
        (base32 "0bp1n771fj44kdp7a00bcvfwirvv2rc803b7g6yf3va7v0j29c8s"))))
    (build-system python-build-system)
    (arguments
     `(#:phases
       (modify-phases %standard-phases
         (replace 'check
           (lambda _
             (invoke "nosetests" "-s" "-v" "skfuzzy")
             #t)))))
    (native-inputs
     `(("python-nose" ,python-nose)))
    (propagated-inputs
     `(("python-networkx" ,python-networkx)
       ("python-numpy" ,python-numpy)
       ("python-scipy" ,python-scipy)))
    (home-page "https://github.com/scikit-fuzzy/scikit-fuzzy")
    (synopsis "Fuzzy logic toolkit for SciPy")
    (description
     "This package implements many useful tools for projects involving fuzzy
logic, also known as grey logic.")
    (license license:bsd-3)))

(define-public python-scikit-image
  (package
    (name "python-scikit-image")
    (version "0.18.1")
    (source
     (origin
       (method url-fetch)
       (uri (pypi-uri "scikit-image" version))
       (sha256
        (base32 "0wgisa03smhrphcjnhq7waa5vyyd32b67hblapjbqrqqj751idpv"))))
    (build-system python-build-system)
    (arguments
     `(#:phases
       (modify-phases %standard-phases
         (add-before 'build 'change-home-dir
           (lambda _
             ;; Change from /homeless-shelter to /tmp for write permission.
             (setenv "HOME" "/tmp")
             #t))
         (replace 'build
           (lambda _
             (invoke "make")))
         (replace 'check
           (lambda _
             ;; The following tests require online data.
             (invoke "python" "-m" "pytest" "skimage" "--doctest-modules" "-k"
                     (string-append "not test_ndim"
                                    " and not test_skin")))))))
    ;; See requirements/ for the list of build and run time requirements.
    ;; NOTE: scikit-image has an optional dependency on python-pooch, however
    ;; propagating it would enable many more tests that require online data.
    (propagated-inputs
     `(("python-cloudpickle" ,python-cloudpickle)
       ("python-dask" ,python-dask)
       ("python-imageio" ,python-imageio)
       ("python-matplotlib" ,python-matplotlib)
       ("python-networkx" ,python-networkx)
       ("python-numpy" ,python-numpy)
       ("python-pillow" ,python-pillow)
       ("python-pywavelets" ,python-pywavelets)
       ("python-scipy" ,python-scipy)
       ("python-tifffile" ,python-tifffile)))
    (native-inputs
     `(("python-codecov" ,python-codecov)
       ("python-cython" ,python-cython)
       ("python-flake8" ,python-flake8)
       ("python-pytest" ,python-pytest)
       ("python-pytest-cov" ,python-pytest-cov)
       ("python-pytest-localserver" ,python-pytest-localserver)
       ("python-wheel" ,python-wheel)))
    (home-page "https://scikit-image.org/")
    (synopsis "Image processing in Python")
    (description
     "Scikit-image is a collection of algorithms for image processing.")
    (license license:bsd-3)))

(define-public python-sgp4
  (package
    (name "python-sgp4")
    (version "2.12")
    (source
     (origin
       (method url-fetch)
       (uri (pypi-uri "sgp4" version))
       (sha256
        (base32 "0dncp9i5b6afkg7f8mj9j0qzsp008b8v73yc0qkmizhpns7mvwvx"))))
    (build-system python-build-system)
    (propagated-inputs
     `(("python-numpy" ,python-numpy)))
    (home-page "https://github.com/brandon-rhodes/python-sgp4")
    (synopsis "Track earth satellite TLE orbits using SGP4")
    (description
     "This package provides a Python implementation of the most recent version
of the SGP4 satellite tracking algorithm.")
    (license license:expat)))

(define-public python-pandas
  (package
    (name "python-pandas")
    (version "1.0.5")
    (source
     (origin
       (method url-fetch)
       (uri (pypi-uri "pandas" version))
       (sha256
        (base32 "1a2gv3g6jr6vb5ca43fkwjl5xf86wpfz8y3zcy787adjl0hdkib9"))))
    (build-system python-build-system)
    (arguments
     `(#:modules ((guix build utils)
                  (guix build python-build-system)
                  (ice-9 ftw)
                  (srfi srfi-26))
       #:phases (modify-phases %standard-phases
                  (add-after 'unpack 'patch-which
                    (lambda* (#:key inputs #:allow-other-keys)
                      (let ((which (assoc-ref inputs "which")))
                        (substitute* "pandas/io/clipboard/__init__.py"
                          (("^WHICH_CMD = .*")
                           (string-append "WHICH_CMD = \"" which "\"\n"))))
                      #t))
                  (add-before 'check 'prepare-x
                    (lambda _
                      (system "Xvfb &")
                      (setenv "DISPLAY" ":0")
                      ;; xsel needs to write a log file.
                      (setenv "HOME" "/tmp")
                      #t))
                  (replace 'check
                    (lambda _
                      (let ((build-directory
                             (string-append
                              (getcwd) "/build/"
                              (car (scandir "build"
                                            (cut string-prefix? "lib." <>))))))
                        ;; Disable the "strict data files" option which causes
                        ;; the build to error out if required data files are
                        ;; not available (as is the case with PyPI archives).
                        (substitute* "setup.cfg"
                          (("addopts = --strict-data-files") "addopts = "))
                        (with-directory-excursion build-directory
                          (invoke "pytest" "-vv" "pandas" "--skip-slow"
                                  "--skip-network"))))))))
    (propagated-inputs
     `(("python-jinja2" ,python-jinja2)
       ("python-numpy" ,python-numpy)
       ("python-openpyxl" ,python-openpyxl)
       ("python-pytz" ,python-pytz)
       ("python-dateutil" ,python-dateutil)
       ("python-xlrd" ,python-xlrd)))
    (inputs
     `(("which" ,which)
       ("xclip" ,xclip)
       ("xsel" ,xsel)))
    (native-inputs
     `(("python-cython" ,python-cython)
       ("python-beautifulsoup4" ,python-beautifulsoup4)
       ("python-lxml" ,python-lxml)
       ("python-html5lib" ,python-html5lib)
       ("python-nose" ,python-nose)
       ("python-pytest" ,python-pytest)
       ("python-pytest-mock" ,python-pytest-mock)
       ;; Needed to test clipboard support.
       ("xorg-server" ,xorg-server-for-tests)))
    (home-page "https://pandas.pydata.org")
    (synopsis "Data structures for data analysis, time series, and statistics")
    (description
     "Pandas is a Python package providing fast, flexible, and expressive data
structures designed to make working with structured (tabular,
multidimensional, potentially heterogeneous) and time series data both easy
and intuitive.  It aims to be the fundamental high-level building block for
doing practical, real world data analysis in Python.")
    (properties `((python2-variant . ,(delay python2-pandas))))
    (license license:bsd-3)))

(define-public python-pandas-0.25
  (package
    (inherit python-pandas)
    (version "0.25.3")
    (source (origin
              (method url-fetch)
              (uri (pypi-uri "pandas" version))
              (sha256
               (base32
                "191048m6kdc6yfvqs9w412lq60cfvigrsb57y0x116lwibgp9njj"))))
    (arguments
     (substitute-keyword-arguments (package-arguments python-pandas)
       ((#:phases phases)
        `(modify-phases ,phases
           (replace 'patch-which
             (lambda* (#:key inputs #:allow-other-keys)
               (let ((which (assoc-ref inputs "which")))
                 (substitute* "pandas/io/clipboard/__init__.py"
                   (("^CHECK_CMD = .*")
                     (string-append "CHECK_CMD = \"" which "\"\n"))))
               #t))
           (delete 'prepare-x)))))))

;; Pandas 0.24.x are the last versions that support Python 2.
(define-public python2-pandas
  (let ((pandas (package-with-python2
                 (strip-python2-variant python-pandas-0.25))))
    (package
      (inherit pandas)
      (version "0.24.2")
      (source (origin
                (method url-fetch)
                (uri (pypi-uri "pandas" version))
                (sha256
                 (base32
                  "18imlm8xbhcbwy4wa957a1fkamrcb0z988z006jpfda3ki09z4ag"))
                (modules '((guix build utils)))
                (snippet
                 '(begin
                    ;; Adjust for renamed error message in Python 2.7.17.  Taken
                    ;; from <https://github.com/pandas-dev/pandas/pull/29294>.
                    (substitute* "pandas/io/parsers.py"
                      (("if 'NULL byte' in msg:")
                       "if 'NULL byte' in msg or 'line contains NUL' in msg:"))
                    #t)))))))

(define-public python-pyflow
  (package
    (name "python-pyflow")
    (version "1.1.20")
    (source (origin
              (method url-fetch)
              (uri (string-append
                    "https://github.com/Illumina/pyflow/releases/download/v"
                    version "/pyflow-" version ".tar.gz"))
              (sha256
               (base32
                "1bvfvviw58cndyn862qnv9nj3d9cd3a0dm4vc4sd9vwq8a6z1riv"))))
    (build-system python-build-system)
    (arguments
     `(#:tests? #f)) ; There is no test suite.
    (home-page "https://illumina.github.io/pyflow/")
    (synopsis "Tool to manage tasks in a task dependency graph")
    (description "This package is a Python module to manage tasks in the
context of a task dependency graph.  It has some similarities to make.")
    (license license:bsd-2)))

(define-public python-bottleneck
  (package
    (name "python-bottleneck")
    (version "1.3.2")
    (source
     (origin
       (method url-fetch)
       (uri (pypi-uri "Bottleneck" version))
       (sha256
        (base32 "0wz5320jx3n4q2nsvwvc7cpi66b46qbals9v53m955rmcq5ry5r0"))))
    (build-system python-build-system)
    (arguments
     `(#:phases
       (modify-phases %standard-phases
         (replace 'check
           (lambda _
             (invoke "python" "setup.py" "pytest"))))))
    (native-inputs
     `(("python-hypothesis" ,python-hypothesis)
       ("python-pytest" ,python-pytest)
       ("python-pytest-runner" ,python-pytest-runner)))
    (propagated-inputs
     `(("python-numpy" ,python-numpy)))
    (home-page "https://github.com/pydata/bottleneck")
    (synopsis "Fast NumPy array functions written in C")
    (description
     "Bottleneck is a collection of fast, NaN-aware NumPy array functions
written in C.")
    (license license:bsd-2)))

(define-public python-baycomp
  (package
    (name "python-baycomp")
    (version "1.0.2")
    (source
     (origin
       (method url-fetch)
       (uri (pypi-uri "baycomp" version))
       (sha256
        (base32 "1c1354a7b3g8slychjgyjxqdm8z40z9kviyl9n4g9kfpdg0p4d64"))))
    (build-system python-build-system)
    (propagated-inputs
     `(("python-matplotlib" ,python-matplotlib)
       ("python-numpy" ,python-numpy)
       ("python-scipy" ,python-scipy)))
    (home-page "https://github.com/janezd/baycomp")
    (synopsis "Library for comparison of Bayesian classifiers")
    (description
     "Baycomp is a library for Bayesian comparison of classifiers.  Functions
in the library compare two classifiers on one or on multiple data sets.  They
compute three probabilities: the probability that the first classifier has
higher scores than the second, the probability that differences are within the
region of practical equivalence (rope), or that the second classifier has
higher scores.")
    (license license:expat)))

(define-public python-xarray
  (package
    (name "python-xarray")
    (version "0.15.1")
    (source (origin
              (method url-fetch)
              (uri (pypi-uri "xarray" version))
              (sha256
               (base32
                "1yx8j66b7rn10m2l6gmn8yr9cn38pi5cj0x0wwpy4hdnhy6i7qv4"))))
    (build-system python-build-system)
    (native-inputs
     `(("python-setuptools-scm" ,python-setuptools-scm)
       ("python-pytest" ,python-pytest)))
    (propagated-inputs
     `(("python-numpy" ,python-numpy)
       ("python-pandas" ,python-pandas)))
    (arguments
     `(#:phases
       (modify-phases %standard-phases
         (replace 'check
           (lambda _
             (invoke "pytest"))))))
    (home-page "https://github.com/pydata/xarray")
    (synopsis "N-D labeled arrays and datasets")
    (description "Xarray (formerly xray) makes working with labelled
multi-dimensional arrays simple, efficient, and fun!

Xarray introduces labels in the form of dimensions, coordinates and attributes
on top of raw NumPy-like arrays, which allows for a more intuitive, more
concise, and less error-prone developer experience.  The package includes a
large and growing library of domain-agnostic functions for advanced analytics
and visualization with these data structures.")
    (license license:asl2.0)))

(define-public python-msgpack-numpy
  (package
    (name "python-msgpack-numpy")
    (version "0.4.6.post0")
    (source
     (origin
       (method url-fetch)
       (uri (pypi-uri "msgpack-numpy" version))
       (sha256
        (base32
         "0syzy645mwcy7lfjwz6pc8f9p2vv1qk4limc8iina3l5nnf0rjyz"))))
    (build-system python-build-system)
    (propagated-inputs
     `(("python-msgpack" ,python-msgpack)
       ("python-numpy" ,python-numpy)))
    (home-page "https://github.com/lebedov/msgpack-numpy")
    (synopsis
     "Numpy data serialization using msgpack")
    (description
     "This package provides encoding and decoding routines that enable the
serialization and deserialization of numerical and array data types provided
by numpy using the highly efficient @code{msgpack} format.  Serialization of
Python's native complex data types is also supported.")
    (license license:bsd-3)))

(define-public python-ruffus
  (package
    (name "python-ruffus")
    (version "2.8.4")
    (source
     (origin
       (method url-fetch)
       (uri (pypi-uri "ruffus" version))
       (sha256
        (base32
         "1ai673k1s94s8b6pyxai8mk17p6zvvyi87rl236fs6ls8mpdklvc"))))
    (build-system python-build-system)
    (arguments
     `(#:phases
       (modify-phases %standard-phases
         (delete 'check)
         (add-after 'install 'check
           (lambda* (#:key tests? inputs outputs #:allow-other-keys)
             (when tests?
               (add-installed-pythonpath inputs outputs)
               (with-directory-excursion "ruffus/test"
                 (invoke "bash" "run_all_unit_tests3.cmd"))))))))
    (native-inputs
     `(("python-pytest" ,python-pytest)))
    (home-page "http://www.ruffus.org.uk")
    (synopsis "Light-weight computational pipeline management")
    (description
     "Ruffus is designed to allow scientific and other analyses to be
automated with the minimum of fuss and the least effort.")
    (license license:expat)))

(define-public python-statannot
  (package
    (name "python-statannot")
    (version "0.2.3")
    (source
     (origin
       (method url-fetch)
       (uri (pypi-uri "statannot" version))
       (sha256
        (base32
         "1f8c2sylzr7lpjbyqxsqlp9xi8rj3d8c9hfh98x4jbb83zxc4026"))))
    (build-system python-build-system)
    (propagated-inputs
     `(("python-numpy" ,python-numpy)
       ("python-seaborn" ,python-seaborn)
       ("python-matplotlib" ,python-matplotlib)
       ("python-pandas" ,python-pandas)
       ("python-scipy" ,python-scipy)))
    (home-page
     "https://github.com/webermarcolivier/statannot")
    (synopsis "Add annotations to existing plots generated by seaborn")
    (description
     "This is a Python package to compute statistical test and add statistical
annotations on an existing boxplots and barplots generated by seaborn.")
    (license license:expat)))

(define-public python-upsetplot
  (package
    (name "python-upsetplot")
    (version "0.4.1")
    (source
     (origin
       (method url-fetch)
       (uri (pypi-uri "UpSetPlot" version))
       (sha256
        (base32
         "0kwljcmsvrxm33y3ssham2bwv4a5m31mv96y9h18va0cv7s3mqn1"))))
    (build-system python-build-system)
    (arguments
     `(#:phases
       (modify-phases %standard-phases
         (add-after 'unpack 'fix-versioning
           (lambda _
             (substitute* "setup.py"
               (("pytest-cov<2.6") "pytest-cov"))))
         (replace 'check
           (lambda* (#:key inputs outputs #:allow-other-keys)
             (add-installed-pythonpath inputs outputs)
             (invoke "pytest" "-v" "--doctest-modules"))))))
    (propagated-inputs
     `(("python-matplotlib" ,python-matplotlib)
       ("python-pandas" ,python-pandas)))
    (native-inputs
     `(("python-pytest-runner" ,python-pytest-runner)
       ("python-pytest-cov" ,python-pytest-cov)))
    (home-page "https://upsetplot.readthedocs.io")
    (synopsis "Draw UpSet plots with Pandas and Matplotlib")
    (description
     "This is a Python implementation of UpSet plots by Lex et al.
UpSet plots are used to visualize set overlaps; like Venn diagrams but more
readable.")
    (license license:bsd-3)))

(define-public python-vedo
  (package
    (name "python-vedo")
    (version "2021.0.3")
    (source
     (origin
       (method git-fetch)
       (uri (git-reference
             (url "https://github.com/marcomusy/vedo")
             (commit version)))
       (file-name (git-file-name name version))
       (sha256
        (base32
         "18i3ajh5jzhpc86di15lwh4jv97jhm627ii877sa4yhv6abzjfpn"))))
    (build-system python-build-system)
    (arguments
     `(#:phases
       (modify-phases %standard-phases
         (add-after 'build 'mpi-setup
           ,%openmpi-setup)
         (replace 'check
           (lambda* (#:key inputs outputs #:allow-other-keys)
             (setenv "HOME" (getcwd))
             (add-installed-pythonpath inputs outputs)
             (with-directory-excursion "tests"
               (for-each (lambda (dir)
                           (with-directory-excursion dir
                             (invoke "./run_all.sh")))
                         '("common" "dolfin")))
             #t)))))
    (inputs        ; for the check phase
     `(("dolfin" ,fenics)
       ("pkgconfig" ,python-pkgconfig)
       ("matplotlib" ,python-matplotlib)))
    (native-inputs ; for python-pkgconfig
     `(("pkg-config" ,pkg-config)))
    (propagated-inputs
     `(("numpy" ,python-numpy)
       ("vtk" ,vtk)))
    (home-page "https://github.com/marcomusy/vedo")
    (synopsis
     "Analysis and visualization of 3D objects and point clouds")
    (description
     "@code{vedo} is a fast and lightweight python module for
scientific analysis and visualization.  The package provides a wide
range of functionalities for working with three-dimensional meshes and
point clouds.  It can also be used to generate high quality
two-dimensional renderings such as scatter plots and histograms.
@code{vedo} is based on @code{vtk} and @code{numpy}, with no other
dependencies.")
    ;; vedo is released under the Expat license.  Included fonts are
    ;; covered by the OFL license and textures by the CC0 license.
    ;; The earth images are in the public domain.
    (license (list license:expat
                   license:silofl1.1
                   license:cc0
                   license:public-domain))))