gnu: hidapi: Fix 'license'.
[jackhill/guix/guix.git] / gnu / packages / maths.scm
1 ;;; GNU Guix --- Functional package management for GNU
2 ;;; Copyright © 2013, 2014, 2015, 2016 Andreas Enge <andreas@enge.fr>
3 ;;; Copyright © 2013 Nikita Karetnikov <nikita@karetnikov.org>
4 ;;; Copyright © 2014, 2016 John Darrington <jmd@gnu.org>
5 ;;; Copyright © 2014, 2015, 2016 Eric Bavier <bavier@member.fsf.org>
6 ;;; Copyright © 2014 Federico Beffa <beffa@fbengineering.ch>
7 ;;; Copyright © 2014 Mathieu Lirzin <mathieu.lirzin@openmailbox.org>
8 ;;; Copyright © 2015, 2016 Ricardo Wurmus <rekado@elephly.net>
9 ;;; Copyright © 2015 Sou Bunnbu <iyzsong@gmail.com>
10 ;;; Copyright © 2015 Mark H Weaver <mhw@netris.org>
11 ;;; Copyright © 2015, 2016 Efraim Flashner <efraim@flashner.co.il>
12 ;;; Copyright © 2015 Fabian Harfert <fhmgufs@web.de>
13 ;;; Copyright © 2016 Roel Janssen <roel@gnu.org>
14 ;;; Copyright © 2016 Kei Kebreau <kei@openmailbox.org>
15 ;;; Copyright © 2016 Ludovic Courtès <ludo@gnu.org>
16 ;;; Copyright © 2016 Leo Famulari <leo@famulari.name>
17 ;;; Copyright © 2016 Thomas Danckaert <post@thomasdanckaert.be>
18 ;;;
19 ;;; This file is part of GNU Guix.
20 ;;;
21 ;;; GNU Guix is free software; you can redistribute it and/or modify it
22 ;;; under the terms of the GNU General Public License as published by
23 ;;; the Free Software Foundation; either version 3 of the License, or (at
24 ;;; your option) any later version.
25 ;;;
26 ;;; GNU Guix is distributed in the hope that it will be useful, but
27 ;;; WITHOUT ANY WARRANTY; without even the implied warranty of
28 ;;; MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
29 ;;; GNU General Public License for more details.
30 ;;;
31 ;;; You should have received a copy of the GNU General Public License
32 ;;; along with GNU Guix. If not, see <http://www.gnu.org/licenses/>.
33
34 (define-module (gnu packages maths)
35 #:use-module (ice-9 regex)
36 #:use-module (gnu packages)
37 #:use-module ((guix licenses) #:prefix license:)
38 #:use-module (guix packages)
39 #:use-module (guix download)
40 #:use-module (guix utils)
41 #:use-module (guix build utils)
42 #:use-module (guix build-system cmake)
43 #:use-module (guix build-system gnu)
44 #:use-module (guix build-system r)
45 #:use-module (gnu packages algebra)
46 #:use-module (gnu packages bison)
47 #:use-module (gnu packages boost)
48 #:use-module (gnu packages check)
49 #:use-module (gnu packages cmake)
50 #:use-module (gnu packages compression)
51 #:use-module (gnu packages curl)
52 #:use-module (gnu packages cyrus-sasl)
53 #:use-module (gnu packages documentation)
54 #:use-module (gnu packages elf)
55 #:use-module (gnu packages flex)
56 #:use-module (gnu packages fltk)
57 #:use-module (gnu packages fontutils)
58 #:use-module (gnu packages gettext)
59 #:use-module (gnu packages gcc)
60 #:use-module (gnu packages gd)
61 #:use-module (gnu packages ghostscript)
62 #:use-module (gnu packages graphviz)
63 #:use-module (gnu packages gtk)
64 #:use-module (gnu packages image)
65 #:use-module (gnu packages less)
66 #:use-module (gnu packages lisp)
67 #:use-module (gnu packages logging)
68 #:use-module (gnu packages gnome)
69 #:use-module (gnu packages guile)
70 #:use-module (gnu packages xorg)
71 #:use-module (gnu packages gl)
72 #:use-module (gnu packages m4)
73 #:use-module (gnu packages mpi)
74 #:use-module (gnu packages multiprecision)
75 #:use-module (gnu packages netpbm)
76 #:use-module (gnu packages pcre)
77 #:use-module (gnu packages popt)
78 #:use-module (gnu packages perl)
79 #:use-module (gnu packages pkg-config)
80 #:use-module (gnu packages python)
81 #:use-module (gnu packages readline)
82 #:use-module (gnu packages tbb)
83 #:use-module (gnu packages shells)
84 #:use-module (gnu packages tcl)
85 #:use-module (gnu packages texinfo)
86 #:use-module (gnu packages tex)
87 #:use-module (gnu packages tls)
88 #:use-module (gnu packages wxwidgets)
89 #:use-module (gnu packages xml)
90 #:use-module (gnu packages zip)
91 #:use-module (srfi srfi-1))
92
93 (define-public c-graph
94 (package
95 (name "c-graph")
96 (version "2.0")
97 (source (origin
98 (method url-fetch)
99 (uri (string-append "mirror://gnu/c-graph/c-graph-" version
100 ".tar.gz"))
101 (sha256 (base32
102 "1hlvpzrh7hzzf533diyfiabzskddi8zx92av9hwkjw3l46z7qv01"))))
103 (build-system gnu-build-system)
104 (inputs
105 `(("fortran" ,gfortran)))
106 (synopsis "Visualizing and demonstrating convolution")
107 (description
108 "GNU C-Graph is a tool for demonstrating the theory of convolution.
109 Thus, it can serve as an excellent aid to students of signal and systems
110 theory in visualizing the convolution process. Rather than forcing the
111 student to write code, the program offers an intuitive interface with
112 interactive dialogs to guide them.")
113 (license license:gpl3+)
114 (home-page "http://www.gnu.org/software/c-graph/")))
115
116 (define-public coda
117 (package
118 (name "coda")
119 (version "2.17.3")
120 (source
121 (origin
122 (method url-fetch)
123 (uri (string-append "https://github.com/stcorp/coda/releases/download/"
124 version "/coda-" version ".tar.gz"))
125 (sha256
126 (base32 "04b9l3wzcix0mnfq77mwnil6cbr8h2mki8myvy0lzn236qcwaq1h"))
127 (patches (search-patches "coda-use-system-libs.patch"))
128 (modules '((guix build utils)))
129 (snippet
130 ;; Make sure we don't use the bundled software.
131 '(for-each (lambda (d)
132 (delete-file-recursively (string-append "libcoda/" d)))
133 '("zlib" "pcre" "expat")))))
134 (native-inputs
135 `(("fortran" ,gfortran)
136 ("python" ,python)
137 ("python-numpy" ,python-numpy)))
138 (inputs
139 `(("zlib" ,zlib)
140 ("pcre" ,pcre)
141 ("expat" ,expat)
142 ("hdf4" ,hdf4-alt)
143 ("hdf5" ,hdf5)))
144 (build-system gnu-build-system)
145 (arguments
146 '(#:configure-flags '("--with-hdf4" "--with-hdf5" "--enable-python"
147 "LIBS= -lz -lpcre -lexpat")))
148 (synopsis "A common interface to various earth observation data formats")
149 (description
150 "The Common Data Access toolbox (CODA) provides a set of interfaces for
151 reading remote sensing data from earth observation data files. It consists of
152 command line applications and interfaces to the C, Fortran, Python, and Java
153 programming languages.")
154 (home-page "https://stcorp.nl/coda")
155 (license license:gpl2+)))
156
157 (define-public units
158 (package
159 (name "units")
160 (version "2.13")
161 (source (origin
162 (method url-fetch)
163 (uri (string-append "mirror://gnu/units/units-" version
164 ".tar.gz"))
165 (sha256 (base32
166 "1awhjw9zjlfb8s5g3yyx63f7ddfcr1sanlbxpqifmrgq24ql198b"))))
167 (build-system gnu-build-system)
168 (synopsis "Conversion between thousands of scales")
169 (description
170 "GNU Units converts numeric quantities between units of measure. It
171 can handle scale changes through adaptive usage of standard scale
172 prefixes (micro-, kilo-, etc.). It can also handle nonlinear
173 conversions such as Fahrenheit to Celsius. Its interpreter is powerful
174 enough to be used effectively as a scientific calculator.")
175 (license license:gpl3+)
176 (home-page "http://www.gnu.org/software/units/")))
177
178 (define-public double-conversion
179 (package
180 (name "double-conversion")
181 (version "1.1.5")
182 (source (origin
183 (method url-fetch)
184 (uri (string-append
185 "https://github.com/floitsch/double-conversion/archive/v"
186 version ".tar.gz"))
187 (file-name (string-append name "-" version ".tar.gz"))
188 (sha256
189 (base32
190 "0cnr8xhyjfxijay8ymkqcph3672wp2lj23qhdmr3m4kia5kpdf83"))))
191 (build-system cmake-build-system)
192 (arguments
193 '(#:test-target "test"
194 #:configure-flags '("-DBUILD_SHARED_LIBS=ON"
195 "-DBUILD_TESTING=ON")))
196 (home-page "https://github.com/floitsch/double-conversion")
197 (synopsis "Conversion routines for IEEE doubles")
198 (description
199 "The double-conversion library provides binary-decimal and decimal-binary
200 routines for IEEE doubles. The library consists of efficient conversion
201 routines that have been extracted from the V8 JavaScript engine.")
202 (license license:bsd-3)))
203
204 (define-public dionysus
205 (package
206 (name "dionysus")
207 (version "1.3.0")
208 (source (origin
209 (method url-fetch)
210 (uri (string-append "mirror://gnu/dionysus/dionysus-" version
211 ".tar.gz"))
212 (sha256
213 (base32
214 "1aqnvw6z33bzqgd1ga571pnx6vq2zrkckm1cz91grv45h4jr9vgs"))))
215 (build-system gnu-build-system)
216 (inputs `(("tcl" ,tcl))) ;for 'tclsh'
217 (synopsis "Local search for universal constants and scientific values")
218 (description
219 "GNU Dionysus is a convenient system for quickly retrieving the values of
220 mathematical constants used in science and engineering. Values can be
221 searched using a simple command-line tool, choosing from three databases:
222 universal constants, atomic numbers, and constants related to
223 semiconductors.")
224 (license license:gpl3+)
225 (home-page "http://www.gnu.org/software/dionysus/")))
226
227 (define-public gsl
228 (package
229 (name "gsl")
230 (version "2.2.1")
231 (source (origin
232 (method url-fetch)
233 (uri (string-append "mirror://gnu/gsl/gsl-"
234 version ".tar.gz"))
235 (sha256
236 (base32
237 "095hp01d8lkqdvv0p1k25kvbisgfdmvx1rzpyc2i8kl2n33kvlhk"))
238 (patches (search-patches "gsl-test-i686.patch"))))
239 (build-system gnu-build-system)
240 (arguments
241 `(#:parallel-tests? #f))
242 (home-page "http://www.gnu.org/software/gsl/")
243 (synopsis "Numerical library for C and C++")
244 (description
245 "The GNU Scientific Library is a library for numerical analysis in C
246 and C++. It includes a wide range of mathematical routines, with over 1000
247 functions in total. Subject areas covered by the library include:
248 differential equations, linear algebra, Fast Fourier Transforms and random
249 numbers.")
250 (license license:gpl3+)))
251
252 (define-public glpk
253 (package
254 (name "glpk")
255 (version "4.60")
256 (source
257 (origin
258 (method url-fetch)
259 (uri (string-append "mirror://gnu/glpk/glpk-"
260 version ".tar.gz"))
261 (sha256
262 (base32
263 "15z2ymzqhxwss6wgdj5f7vkyqlqdsjgrvm0x871kmlx0n0664mhk"))))
264 (build-system gnu-build-system)
265 (inputs
266 `(("gmp" ,gmp)))
267 (arguments
268 `(#:configure-flags '("--with-gmp")))
269 (home-page "http://www.gnu.org/software/glpk/")
270 (synopsis "GNU Linear Programming Kit, supporting the MathProg language")
271 (description
272 "GLPK is a C library for solving large-scale linear programming (LP),
273 mixed integer programming (MIP), and other related problems. It supports the
274 GNU MathProg modeling language, a subset of the AMPL language, and features a
275 translator for the language. In addition to the C library, a stand-alone
276 LP/MIP solver is included in the package.")
277 (license license:gpl3+)))
278
279 (define-public 4ti2
280 (package
281 (name "4ti2")
282 (version "1.6.7")
283 (source
284 (origin
285 (method url-fetch)
286 (uri (string-append "http://www.4ti2.de/version_" version
287 "/4ti2-" version ".tar.gz"))
288 (sha256
289 (base32
290 "1frix3rnm9ffr93alqzw4cavxbfpf524l8rfbmcpyhwd3n1km0yl"))))
291 (build-system gnu-build-system)
292 (native-inputs
293 `(("which" ,(@ (gnu packages base) which)))) ; for the tests
294 (inputs
295 `(("glpk" ,glpk)
296 ("gmp" ,gmp)))
297 (home-page "http://www.4ti2.de/")
298 (synopsis "Mathematical tool suite for problems on linear spaces")
299 (description
300 "4ti2 implements algorithms for solving algebraic, geometric and
301 combinatorial problems on linear spaces. Among others, it solves systems
302 of linear equations, computes extreme rays of polyhedral cones, solves
303 integer programming problems and computes Markov bases for statistics.")
304 (license license:gpl2+)))
305
306 (define-public cddlib
307 (package
308 (name "cddlib")
309 (version "0.94h")
310 (source
311 (origin
312 (method url-fetch)
313 (uri (string-append "ftp://ftp.ifor.math.ethz.ch/pub/fukuda/cdd/cddlib-"
314 (string-delete #\. version) ".tar.gz"))
315 (sha256
316 (base32
317 "1dasasscwfg793q8fwzgwf64xwj7w62yfvszpr8x8g38jka08vgy"))))
318 (build-system gnu-build-system)
319 (inputs
320 `(("gmp" ,gmp)))
321 (home-page "https://www.inf.ethz.ch/personal/fukudak/cdd_home/index.html")
322 (synopsis "Library for convex hulls and extreme rays of polyhedra")
323 (description
324 "The C-library cddlib implements the Double Description Method of
325 Motzkin et al. for generating all vertices (i.e. extreme points) and extreme
326 rays of a general convex polyhedron given by a system of linear inequalities
327 in arbitrary dimension. It can also be used for the converse operation of
328 computing convex hulls.")
329 (license license:gpl2+)))
330
331 (define-public arpack-ng
332 (package
333 (name "arpack-ng")
334 (version "3.2.0")
335 (source
336 (origin
337 (method url-fetch)
338 (uri (string-append "https://github.com/opencollab/arpack-ng/archive/"
339 version ".tar.gz"))
340 (file-name (string-append name "-" version ".tar.gz"))
341 (sha256
342 (base32
343 "1fwch6vipms1ispzg2djvbzv5wag36f1dmmr3xs3mbp6imfyhvff"))))
344 (build-system gnu-build-system)
345 (home-page "https://github.com/opencollab/arpack-ng")
346 (inputs
347 `(("lapack" ,lapack)
348 ("fortran" ,gfortran)))
349 (synopsis "Fortran subroutines for solving eigenvalue problems")
350 (description
351 "ARPACK-NG is a collection of Fortran77 subroutines designed to solve
352 large scale eigenvalue problems.")
353 (license (license:non-copyleft "file://COPYING"
354 "See COPYING in the distribution."))))
355
356 (define-public arpack-ng-openmpi
357 (package (inherit arpack-ng)
358 (name "arpack-ng-openmpi")
359 (inputs
360 `(("mpi" ,openmpi)
361 ,@(package-inputs arpack-ng)))
362 (arguments `(#:configure-flags '("--enable-mpi")))
363 (synopsis "Fortran subroutines for solving eigenvalue problems with MPI")))
364
365 (define-public lapack
366 (package
367 (name "lapack")
368 (version "3.5.0")
369 (source
370 (origin
371 (method url-fetch)
372 (uri (string-append "http://www.netlib.org/lapack/lapack-"
373 version ".tgz"))
374 (sha256
375 (base32
376 "0lk3f97i9imqascnlf6wr5mjpyxqcdj73pgj97dj2mgvyg9z1n4s"))))
377 (build-system cmake-build-system)
378 (home-page "http://www.netlib.org/lapack/")
379 (inputs `(("fortran" ,gfortran)
380 ("python" ,python-2)))
381 (arguments
382 `(#:configure-flags '("-DBUILD_SHARED_LIBS:BOOL=YES"
383 "-DLAPACKE=ON")
384 #:phases (alist-cons-before
385 'check 'patch-python
386 (lambda* (#:key inputs #:allow-other-keys)
387 (let ((python (assoc-ref inputs "python")))
388 (substitute* "lapack_testing.py"
389 (("/usr/bin/env python") python))))
390 %standard-phases)))
391 (synopsis "Library for numerical linear algebra")
392 (description
393 "LAPACK is a Fortran 90 library for solving the most commonly occurring
394 problems in numerical linear algebra.")
395 (license (license:non-copyleft "file://LICENSE"
396 "See LICENSE in the distribution."))))
397
398 (define-public scalapack
399 (package
400 (name "scalapack")
401 (version "2.0.2")
402 (source
403 (origin
404 (method url-fetch)
405 (uri (string-append "http://www.netlib.org/scalapack/scalapack-"
406 version ".tgz"))
407 (sha256
408 (base32
409 "0p1r61ss1fq0bs8ynnx7xq4wwsdvs32ljvwjnx6yxr8gd6pawx0c"))))
410 (build-system cmake-build-system)
411 (inputs
412 `(("mpi" ,openmpi)
413 ("fortran" ,gfortran)
414 ("lapack" ,lapack))) ;for testing only
415 (arguments
416 `(#:configure-flags `("-DBUILD_SHARED_LIBS:BOOL=YES")))
417 (home-page "http://www.netlib.org/scalapack/")
418 (synopsis "Library for scalable numerical linear algebra")
419 (description
420 "ScaLAPACK is a Fortran 90 library of high-performance linear algebra
421 routines on parallel distributed memory machines. ScaLAPACK solves dense and
422 banded linear systems, least squares problems, eigenvalue problems, and
423 singular value problems.")
424 (license (license:bsd-style "file://LICENSE"
425 "See LICENSE in the distribution."))))
426
427 (define-public gnuplot
428 ;; Gnuplot version 5.0.4 was updated in-place, resulting in a hash mismatch.
429 ;; This can be removed at the next version update.
430 (let ((upstream-version "5.0.4")
431 (guix-revision "1"))
432 (package
433 (name "gnuplot")
434 (version (string-append upstream-version "-" guix-revision))
435 (source
436 (origin
437 (method url-fetch)
438 (uri (string-append "mirror://sourceforge/gnuplot/gnuplot/"
439 upstream-version "/gnuplot-"
440 upstream-version ".tar.gz"))
441 (sha256
442 (base32
443 "07n3w12dkcxjnhsvsliaqnkhajhi818v6q8mkpmpbplbf92vh70m"))))
444 (build-system gnu-build-system)
445 (inputs `(("readline" ,readline)
446 ("cairo" ,cairo)
447 ("pango" ,pango)
448 ("gd" ,gd)))
449 (native-inputs `(("pkg-config" ,pkg-config)
450 ("texlive" ,texlive-minimal)))
451 (home-page "http://www.gnuplot.info")
452 (synopsis "Command-line driven graphing utility")
453 (description "Gnuplot is a portable command-line driven graphing
454 utility. It was originally created to allow scientists and students to
455 visualize mathematical functions and data interactively, but has grown to
456 support many non-interactive uses such as web scripting. It is also used as a
457 plotting engine by third-party applications like Octave.")
458 ;; X11 Style with the additional restriction that derived works may only be
459 ;; distributed as patches to the original.
460 (license (license:fsf-free
461 "http://gnuplot.cvs.sourceforge.net/gnuplot/gnuplot/Copyright")))))
462
463 (define-public gctp
464 (package
465 (name "gctp")
466 (version "2.0.0")
467 (source
468 (origin
469 (method url-fetch)
470 (uri (string-append "https://github.com/OkoSanto/GCTP/archive/v"
471 version ".tar.gz"))
472 (file-name (string-append name "-" version ".tar.gz"))
473 (sha256
474 (base32
475 "0l9aqnqynh9laicn5dxf3rsb1n14xiks79wbyqccirzmjqd1c1x4"))))
476 (native-inputs
477 `(("fortran" ,gfortran)))
478 (build-system gnu-build-system)
479 (synopsis "General Cartographic Transformation Package (GCTP)")
480 (description
481 "The General Cartographic Transformation Package (GCTP) is a system of
482 software routines designed to permit the transformation of coordinate pairs
483 from one map projection to another. The GCTP is the standard computer
484 software used by the National Mapping Division for map projection
485 computations.")
486 (home-page "https://github.com/OkoSanto/GCTP")
487 (license license:public-domain))) ;https://www2.usgs.gov/laws/info_policies.html
488
489 (define-public hdf4
490 (package
491 (name "hdf4")
492 (version "4.2.11")
493 (source
494 (origin
495 (method url-fetch)
496 (uri (string-append "https://support.hdfgroup.org/ftp/HDF/releases/HDF"
497 version "/src/hdf-" version ".tar.bz2"))
498 (sha256
499 (base32 "16yr50j845zlfx20skmw3y75ww77akk9gg0affjqkg66ih5r03mv"))
500 (patches (search-patches "hdf4-architectures.patch"
501 "hdf4-reproducibility.patch"
502 "hdf4-shared-fortran.patch"))))
503
504 (build-system gnu-build-system)
505 (native-inputs
506 `(("gfortran" ,gfortran)
507 ("bison" ,bison)
508 ("flex" ,flex)))
509 (inputs
510 `(("zlib" ,zlib)
511 ("libjpeg" ,libjpeg)))
512 (arguments
513 `(#:parallel-tests? #f
514 #:configure-flags '("--enable-shared")
515 #:phases
516 (modify-phases %standard-phases
517 (add-before 'configure 'patchbuild
518 (lambda _
519 (substitute*
520 '("mfhdf/hdfimport/testutil.sh.in" "hdf/util/testutil.sh.in")
521 (("/bin/rm") "rm")
522 (("/bin/mkdir") "mkdir"))
523 (substitute* (find-files "." "^Makefile\\.in$")
524 (("@HDF_BUILD_XDR_TRUE@XDR_ADD = \
525 -R\\$\\(abs_top_builddir\\)/mfhdf/xdr/\\.libs") "")
526 (("@HDF_BUILD_SHARED_TRUE@AM_LDFLAGS = \
527 -R\\$\\(abs_top_builddir\\)/mfhdf/libsrc/\\.libs \
528 -R\\$\\(abs_top_builddir\\)/hdf/src/\\.libs \\$\\(XDR_ADD\\)") "")))))))
529 (home-page "https://www.hdfgroup.org/products/hdf4/")
530 (synopsis
531 "Library and multi-object file format for storing and managing data")
532 (description "HDF4 is a library and multi-object file format for storing
533 and managing data between machines. HDF4 is an older hierarchical data format,
534 incompatible with HDF5.")
535 (license
536 (license:non-copyleft
537 "https://www.hdfgroup.org/ftp/HDF/HDF_Current/src/unpacked/COPYING"))))
538
539 (define-public hdf4-alt
540 (package
541 (inherit hdf4)
542 (name "hdf4-alt")
543 (arguments
544 (substitute-keyword-arguments (package-arguments hdf4)
545 ((#:configure-flags flags) `(cons* "--disable-netcdf" ,flags))))
546 (synopsis
547 "HDF4 without netCDF API, can be combined with the regular netCDF library")))
548
549 (define-public hdf5
550 (package
551 (name "hdf5")
552 (version "1.8.17")
553 (source
554 (origin
555 (method url-fetch)
556 (uri (string-append "http://www.hdfgroup.org/ftp/HDF5/releases/hdf5-"
557 version "/src/hdf5-"
558 version ".tar.bz2"))
559 (sha256
560 (base32 "0sj8x0gfs5fb28gipnynb9wpkz113h8wq9sva9mxx66kv27xsdgw"))
561 (patches (list (search-patch "hdf5-config-date.patch")))))
562 (build-system gnu-build-system)
563 (inputs
564 `(("zlib" ,zlib)))
565 (arguments
566 `(#:phases
567 (modify-phases %standard-phases
568 (add-before 'configure 'patch-configure
569 (lambda _
570 (substitute* "configure"
571 (("/bin/mv") "mv"))
572 #t))
573 (add-after 'install 'patch-references
574 (lambda* (#:key inputs outputs #:allow-other-keys)
575 (let ((bin (string-append (assoc-ref outputs "out") "/bin"))
576 (zlib (assoc-ref inputs "zlib")))
577 (substitute* (find-files bin "h5p?cc")
578 (("-lz" lib)
579 (string-append "-L" zlib "/lib " lib)))
580 #t))))))
581 (home-page "http://www.hdfgroup.org")
582 (synopsis "Management suite for extremely large and complex data")
583 (description "HDF5 is a suite that makes possible the management of
584 extremely large and complex data collections.")
585 (license (license:x11-style
586 "http://www.hdfgroup.org/ftp/HDF5/current/src/unpacked/COPYING"))))
587
588 (define-public hdf-eos2
589 (package
590 (name "hdf-eos2")
591 (version "19.1.0")
592 (source
593 (origin
594 (method url-fetch)
595 (uri "ftp://edhs1.gsfc.nasa.gov\
596 /edhs/hdfeos/latest_release/HDF-EOS2.19v1.00.tar.Z")
597 (sha256
598 (base32 "0c9fcz25s292ldap12wxmlrvnyz99z24p63d8fwx51bf8s0s1zrz"))
599 (patches (search-patches "hdf-eos2-remove-gctp.patch"
600 "hdf-eos2-build-shared.patch"
601 "hdf-eos2-fortrantests.patch"))))
602 (build-system gnu-build-system)
603 (native-inputs
604 `(("gfortran" ,gfortran)))
605 (inputs
606 `(("hdf4" ,hdf4-alt) ; assume most HDF-EOS2 users won't use the HDF4 netCDF API
607 ("zlib" ,zlib)
608 ("libjpeg" ,libjpeg)
609 ("gctp" ,gctp)))
610 (arguments
611 `( #:configure-flags '("--enable-install-include" "--enable-shared"
612 "CC=h4cc -Df2cFortran" "LIBS=-lgctp")
613 #:parallel-tests? #f))
614 (home-page "http://hdfeos.org/software/library.php#HDF-EOS2")
615 (synopsis "HDF4-based data format for NASA's Earth Observing System")
616 (description "HDF-EOS2 is a software library built on HDF4 which supports
617 the construction of data structures used in NASA's Earth Observing
618 System (Grid, Point and Swath).")
619
620 ;; Source files carry a permissive license header.
621 (license (license:non-copyleft home-page))))
622
623 (define-public hdf-eos5
624 (package
625 (name "hdf-eos5")
626 (version "1.15")
627 (source (origin
628 (method url-fetch)
629 (uri (string-append "ftp://edhs1.gsfc.nasa.gov\
630 /edhs/hdfeos5/latest_release/HDF-EOS5." version ".tar.Z"))
631 (sha256
632 (base32
633 "1p83333nzzy8rn5chxlm0hrkjjnhh2w1ji8ac0f9q4xzg838i58i"))
634 (patches (search-patches "hdf-eos5-build-shared.patch"
635 "hdf-eos5-remove-gctp.patch"
636 "hdf-eos5-fix-szip.patch"
637 "hdf-eos5-fortrantests.patch"))))
638 (native-inputs
639 `(("gfortran" ,gfortran)))
640 (build-system gnu-build-system)
641 (inputs
642 `(("hdf5" ,hdf5)
643 ("zlib" ,zlib)
644 ("gctp" ,gctp)))
645 (arguments
646 `(#:configure-flags '("--enable-install-include" "--enable-shared"
647 "CC=h5cc -Df2cFortran" "LIBS=-lgctp")
648 #:parallel-tests? #f))
649 (synopsis "HDF5-based data format for NASA's Earth Observing System")
650 (description
651 "HDF-EOS5 is a software library built on HDF5 to support the construction
652 of data structures used in NASA's Earth Observing System (Grid, Point and
653 Swath).")
654 (home-page "http://www.hdfeos.org/software/library.php#HDF-EOS5")
655
656 ;; Source files carry a permissive license header.
657 (license (license:non-copyleft home-page))))
658
659 (define-public hdf5-parallel-openmpi
660 (package (inherit hdf5)
661 (name "hdf5-parallel-openmpi")
662 (inputs
663 `(("mpi" ,openmpi)
664 ,@(package-inputs hdf5)))
665 (arguments
666 (substitute-keyword-arguments `(#:configure-flags '("--enable-parallel")
667 ,@(package-arguments hdf5))
668 ((#:phases phases)
669 `(modify-phases ,phases
670 (add-before 'check 'patch-tests
671 (lambda _
672 ;; OpenMPI's mpirun will exit with non-zero status if it
673 ;; detects an "abnormal termination", i.e. any process not
674 ;; calling MPI_Finalize(). Since the test is explicitely
675 ;; avoiding MPI_Finalize so as not to have at_exit and thus
676 ;; H5C_flush_cache from being called, mpirun will always
677 ;; complain, so turn this test off.
678 (substitute* "testpar/Makefile"
679 (("(^TEST_PROG_PARA.*)t_pflush1(.*)" front back)
680 (string-append front back "\n")))
681 (substitute* "tools/h5diff/testph5diff.sh"
682 (("/bin/sh") (which "sh")))
683 #t))))))
684 (synopsis "Management suite for data with parallel IO support")))
685
686 (define-public h5check
687 (package
688 (name "h5check")
689 (version "2.0.1")
690 (source
691 (origin
692 (method url-fetch)
693 (uri (string-append "http://www.hdfgroup.org/ftp/HDF5/tools/"
694 "h5check/src/h5check-" version ".tar.gz"))
695 (sha256
696 (base32
697 "1gm76jbwhz9adbxgn14zx8cj33dmjdr2g5xcy0m9c2gakp8w59kj"))))
698 (build-system gnu-build-system)
699 (inputs `(("hdf5" ,hdf5))) ;h5cc for tests
700 (home-page "https://www.hdfgroup.org/products/hdf5_tools/h5check.html")
701 (synopsis "HDF5 format checker")
702 (description "@code{h5check} is a validation tool for verifying that an
703 HDF5 file is encoded according to the HDF File Format Specification.")
704 (license (license:x11-style "file://COPYING"))))
705
706 (define-public netcdf
707 (package
708 (name "netcdf")
709 (version "4.4.0")
710 (source
711 (origin
712 (method url-fetch)
713 (uri (string-append "ftp://ftp.unidata.ucar.edu/pub/netcdf/"
714 "netcdf-" version ".tar.gz"))
715 (sha256
716 (base32
717 "0y6gdcplarwqqnrav2xg1xd6ih732rzzbmdw78v3rl5b8mwcnh0d"))
718 (patches (list (search-patch "netcdf-config-date.patch")))))
719 (build-system gnu-build-system)
720 (native-inputs
721 `(("m4" ,m4)
722 ("doxygen" ,doxygen)
723 ("graphviz" ,graphviz)))
724 (inputs
725 `(("hdf5" ,hdf5)
726 ("zlib" ,zlib)))
727 (arguments
728 `(#:configure-flags '("--enable-doxygen" "--enable-dot")
729 #:parallel-tests? #f)) ;various race conditions
730 (home-page "http://www.unidata.ucar.edu/software/netcdf/")
731 (synopsis "Library for scientific data")
732 (description "NetCDF is an interface for scientific data access and a
733 software library that provides an implementation of the interface. The netCDF
734 library defines a machine-independent format for representing scientific data.
735 Together, the interface, library, and format support the creation, access, and
736 sharing of scientific data.")
737 (license (license:x11-style "file://COPYRIGHT"))))
738
739 (define-public netcdf-parallel-openmpi
740 (package (inherit netcdf)
741 (name "netcdf-parallel-openmpi")
742 (inputs
743 `(("mpi" ,openmpi)
744 ,@(alist-replace "hdf5" (list hdf5-parallel-openmpi)
745 (package-inputs netcdf))))
746 ;; TODO: Replace pkg-config references in nc-config with absolute references
747 (arguments
748 (substitute-keyword-arguments (package-arguments netcdf)
749 ((#:configure-flags flags)
750 `(cons* "CC=mpicc" "CXX=mpicxx"
751 "--enable-parallel-tests"
752 ;; Shared libraries not supported with parallel IO.
753 "--disable-shared" "--with-pic"
754 ,flags))))))
755
756 (define-public nlopt
757 (package
758 (name "nlopt")
759 (version "2.4.2")
760 (source (origin
761 (method url-fetch)
762 (uri (string-append "http://ab-initio.mit.edu/nlopt/nlopt-"
763 version ".tar.gz"))
764 (sha256
765 (base32 "12cfkkhcdf4zmb6h7y6qvvdvqjs2xf9sjpa3rl3bq76px4yn76c0"))))
766 (build-system gnu-build-system)
767 (arguments
768 `(;; Shared libraries are not built by default. They are required to
769 ;; build the Guile, Octave, and Python bindings.
770 #:configure-flags '("--enable-shared")
771
772 #:phases
773 (modify-phases %standard-phases
774 (add-before 'configure 'set-libnlopt-file-name
775 (lambda* (#:key outputs #:allow-other-keys)
776 ;; Make sure the Scheme module refers to the library by its
777 ;; absolute file name (we cannot do that from a snippet
778 ;; because the expansion of @libdir@ contains
779 ;; ${exec_prefix}.)
780 (let ((out (assoc-ref outputs "out")))
781 (substitute* "swig/nlopt.scm.in"
782 (("libnlopt")
783 (string-append out "/lib/libnlopt")))
784 #t))))))
785 (inputs `(("guile" ,guile-2.0)))
786 (native-inputs `(("pkg-config" ,pkg-config)))
787 (home-page "http://ab-initio.mit.edu/wiki/")
788 (synopsis "Library for nonlinear optimization")
789 (description "NLopt is a library for nonlinear optimization, providing a
790 common interface for a number of different free optimization routines available
791 online as well as original implementations of various other algorithms.")
792 (license license:lgpl2.1+)))
793
794 (define-public ipopt
795 (package
796 (name "ipopt")
797 (version "3.12.5")
798 (source (origin
799 (method url-fetch)
800 (uri (string-append
801 "http://www.coin-or.org/download/source/Ipopt/Ipopt-"
802 version".tgz"))
803 (sha256
804 (base32
805 "09bk2hqy2vgi4yi76xng9zxakddwqy3wij9nx7wf2vfbxxpazrsk"))
806 (modules '((guix build utils)))
807 (snippet
808 ;; Make sure we don't use the bundled software.
809 '(delete-file-recursively "ThirdParty"))))
810 (build-system gnu-build-system)
811 (arguments
812 '(#:phases (modify-phases %standard-phases
813 (add-after 'install 'add--L-flags-in-ipopt.pc
814 (lambda* (#:key inputs outputs #:allow-other-keys)
815 ;; The '.pc' file lists '-llapack -lblas' in "Libs";
816 ;; move it to "Libs.private" where it belongs, and add a
817 ;; '-L' flag for LAPACK.
818 (let ((out (assoc-ref outputs "out"))
819 (lapack (assoc-ref inputs "lapack")))
820 (substitute* (string-append out "/lib/pkgconfig/"
821 "ipopt.pc")
822 (("Libs: (.*)-llapack -lblas(.*)$" _ before after)
823 (string-append "Libs: " before " " after "\n"
824 "Libs.private: " before
825 "-L" lapack "/lib -llapack -lblas "
826 after "\n")))
827 #t))))))
828 (native-inputs
829 `(("gfortran" ,gfortran)))
830 (inputs
831 ;; TODO: Maybe add dependency on COIN-MUMPS, ASL, and HSL.
832 `(("lapack" ,lapack))) ;for both libblas and liblapack
833 (home-page "http://www.coin-or.org")
834 (synopsis "Large-scale nonlinear optimizer")
835 (description
836 "The Interior Point Optimizer (IPOPT) is a software package for
837 large-scale nonlinear optimization. It provides C++, C, and Fortran
838 interfaces.")
839 (license license:epl1.0)))
840
841 (define-public ceres
842 (package
843 (name "ceres-solver")
844 (version "1.11.0")
845 (home-page "http://ceres-solver.org/")
846 (source (origin
847 (method url-fetch)
848 (uri (string-append home-page "ceres-solver-"
849 version ".tar.gz"))
850 (sha256
851 (base32
852 "0i7qkbf8g6pd8arxzldppga26ckv93y8zldsfz6wbd4n6b1nqrjd"))))
853 (build-system cmake-build-system)
854 (arguments
855 ;; TODO: Build HTML user documentation and install separately.
856 '(#:configure-flags '("-DBUILD_EXAMPLES=OFF"
857 "-DBUILD_SHARED_LIBS=ON")
858
859 #:phases (modify-phases %standard-phases
860 (add-before 'configure 'set-library-directory
861 (lambda _
862 ;; Install libraries to lib/, not lib64/.
863 (substitute* "internal/ceres/CMakeLists.txt"
864 (("set\\(LIB_SUFFIX \"64\"\\)")
865 "set(LIB_SUFFIX \"\")"))
866 #t)))))
867 (native-inputs
868 `(("pkg-config" ,pkg-config)))
869 (propagated-inputs
870 `(("glog" ,glog))) ;for #include <glog/glog.h>
871 (inputs
872 `(("eigen" ,eigen)
873 ("blas" ,openblas)
874 ("lapack" ,lapack)
875 ("suitesparse" ,suitesparse)
876 ("gflags" ,gflags)))
877 (synopsis "C++ library for solving large optimization problems")
878 (description
879 "Ceres Solver is a C++ library for modeling and solving large,
880 complicated optimization problems. It is a feature rich, mature and
881 performant library which has been used in production since 2010. Ceres Solver
882 can solve two kinds of problems:
883 @enumerate
884 @item non-linear least squares problems with bounds constraints;
885 @item general unconstrained optimization problems.
886 @end enumerate\n")
887 (license license:bsd-3)))
888
889 ;; For a fully featured Octave, users are strongly recommended also to install
890 ;; the following packages: texinfo, less, ghostscript, gnuplot.
891 (define-public octave
892 (package
893 (name "octave")
894 (version "4.0.3")
895 (source
896 (origin
897 (method url-fetch)
898 (uri (string-append "mirror://gnu/octave/octave-"
899 version ".tar.xz"))
900 (sha256
901 (base32
902 "11day29k4yfvxh4101x5yf26ld992x5n6qvmhjjk6mzsd26fqayw"))))
903 (build-system gnu-build-system)
904 (inputs
905 `(("lapack" ,lapack)
906 ("readline" ,readline)
907 ("glpk" ,glpk)
908 ("fftw" ,fftw)
909 ("fftwf" ,fftwf)
910 ("arpack" ,arpack-ng)
911 ("pcre" ,pcre)
912 ("fltk" ,fltk)
913 ("fontconfig" ,fontconfig)
914 ("freetype" ,freetype)
915 ("hdf5" ,hdf5)
916 ("libxft" ,libxft)
917 ("mesa" ,mesa)
918 ("glu" ,glu)
919 ("zlib" ,zlib)))
920 (native-inputs
921 `(("gfortran" ,gfortran)
922 ("pkg-config" ,pkg-config)
923 ("perl" ,perl)
924 ;; The following inputs are not actually used in the build process.
925 ;; However, the ./configure gratuitously tests for their existence and
926 ;; assumes that programs not present at build time are also not, and
927 ;; can never be, available at run time! If these inputs are therefore
928 ;; not present, support for them will be built out. However, Octave
929 ;; will still run without them, albeit without the features they
930 ;; provide.
931 ("less" ,less)
932 ("texinfo" ,texinfo)
933 ("ghostscript" ,ghostscript)
934 ("gnuplot" ,gnuplot)))
935 (arguments
936 `(#:configure-flags
937 (list (string-append "--with-shell="
938 (assoc-ref %build-inputs "bash")
939 "/bin/sh"))))
940 (home-page "http://www.gnu.org/software/octave/")
941 (synopsis "High-level language for numerical computation")
942 (description "GNU Octave is a high-level interpreted language that is
943 specialized for numerical computations. It can be used for both linear and
944 non-linear applications and it provides great support for visualizing results.
945 Work may be performed both at the interactive command-line as well as via
946 script files.")
947 (license license:gpl3+)))
948
949 (define-public gmsh
950 (package
951 (name "gmsh")
952 (version "2.11.0")
953 (source
954 (origin
955 (method url-fetch)
956 (uri (string-append "http://www.geuz.org/gmsh/src/gmsh-"
957 version "-source.tgz"))
958 (sha256
959 (base32 "1ilplibvjgf7a905grpnclrvkmqy9fgrpl7xyp3w4yl1qc682v9b"))
960 (modules '((guix build utils)))
961 (snippet
962 ;; Remove non-free METIS code
963 '(delete-file-recursively "contrib/Metis"))))
964 (build-system cmake-build-system)
965 (propagated-inputs
966 `(("fltk" ,fltk)
967 ("gfortran" ,gfortran)
968 ("gmp" ,gmp)
969 ("hdf5" ,hdf5)
970 ("lapack" ,lapack)
971 ("mesa" ,mesa)
972 ("glu" ,glu)
973 ("libx11" ,libx11)
974 ("libxext" ,libxext)))
975 (inputs
976 `(("fontconfig" ,fontconfig)
977 ("libxft" ,libxft)))
978 (arguments
979 `(#:configure-flags `("-DENABLE_METIS:BOOL=OFF"
980 "-DENABLE_BUILD_SHARED:BOOL=ON"
981 "-DENABLE_BUILD_DYNAMIC:BOOL=ON")
982 #:phases (modify-phases %standard-phases
983 (replace
984 'check
985 (lambda _
986 (zero? (system* "make" "test"
987 ;; Disable this test. See
988 ;; https://geuz.org/trac/gmsh/ticket/271
989 "ARGS=-E component8_in_a_box")))))))
990 (home-page "http://www.geuz.org/gmsh/")
991 (synopsis "3D finite element grid generator")
992 (description "Gmsh is a 3D finite element grid generator with a built-in
993 CAD engine and post-processor. Its design goal is to provide a fast, light
994 and user-friendly meshing tool with parametric input and advanced
995 visualization capabilities. Gmsh is built around four modules: geometry,
996 mesh, solver and post-processing. The specification of any input to these
997 modules is done either interactively using the graphical user interface or in
998 ASCII text files using Gmsh's own scripting language.")
999 (license license:gpl2+)))
1000
1001 (define-public petsc
1002 (package
1003 (name "petsc")
1004 (version "3.7.2")
1005 (source
1006 (origin
1007 (method url-fetch)
1008 ;; The *-lite-* tarball does not contain the *large* documentation
1009 (uri (string-append "http://ftp.mcs.anl.gov/pub/petsc/release-snapshots/"
1010 "petsc-lite-" version ".tar.gz"))
1011 (sha256
1012 (base32 "0jfrq6rd4zagw1iimz05m2w91k0jvz3qbik1lk8pqcxw3rvdqk5d"))))
1013 (build-system gnu-build-system)
1014 (native-inputs
1015 `(("python" ,python-2)
1016 ("perl" ,perl)))
1017 (inputs
1018 `(("gfortran" ,gfortran)
1019 ("lapack" ,lapack)
1020 ("superlu" ,superlu)
1021 ;; leaving out hdf5 and fftw, as petsc expects them to be built with mpi
1022 ;; leaving out opengl, as configuration seems to only be for mac
1023 ))
1024 (arguments
1025 `(#:test-target "test"
1026 #:parallel-build? #f ;build is parallel by default
1027 #:configure-flags
1028 `("--with-mpi=0"
1029 "--with-openmp=1"
1030 "--with-superlu=1"
1031 ,(string-append "--with-superlu-include="
1032 (assoc-ref %build-inputs "superlu") "/include")
1033 ,(string-append "--with-superlu-lib="
1034 (assoc-ref %build-inputs "superlu") "/lib/libsuperlu.a"))
1035 #:phases
1036 (modify-phases %standard-phases
1037 (replace 'configure
1038 ;; PETSc's configure script is actually a python script, so we can't
1039 ;; run it with bash.
1040 (lambda* (#:key outputs (configure-flags '())
1041 #:allow-other-keys)
1042 (let* ((prefix (assoc-ref outputs "out"))
1043 (flags `(,(string-append "--prefix=" prefix)
1044 ,@configure-flags)))
1045 (format #t "build directory: ~s~%" (getcwd))
1046 (format #t "configure flags: ~s~%" flags)
1047 (zero? (apply system* "./configure" flags)))))
1048 (add-after 'configure 'clean-local-references
1049 (lambda* (#:key inputs outputs #:allow-other-keys)
1050 (let ((out (assoc-ref outputs "out")))
1051 (substitute* (find-files "." "^petsc(conf|machineinfo).h$")
1052 ;; Prevent build directory from leaking into compiled code
1053 (((getcwd)) out)
1054 ;; Scrub timestamp for reproducibility
1055 ((".*Libraries compiled on.*") ""))
1056 #t)))
1057 (add-after 'install 'clean-install
1058 ;; Try to keep installed files from leaking build directory names.
1059 (lambda* (#:key inputs outputs #:allow-other-keys)
1060 (let ((out (assoc-ref outputs "out")))
1061 (substitute* (map (lambda (file)
1062 (string-append out "/lib/petsc/conf/" file))
1063 '("petscvariables"))
1064 (((getcwd)) out))
1065 ;; Make compiler references point to the store
1066 (substitute* (string-append out "/lib/petsc/conf/petscvariables")
1067 (("= (gcc|g\\+\\+|gfortran)" _ compiler)
1068 (string-append "= " (which compiler))))
1069 ;; PETSc installs some build logs, which aren't necessary.
1070 (for-each (lambda (file)
1071 (let ((f (string-append out "/lib/petsc/conf/" file)))
1072 (when (file-exists? f)
1073 (delete-file f))))
1074 '("configure.log" "make.log" "gmake.log"
1075 "test.log" "error.log" "RDict.db"
1076 "PETScBuildInternal.cmake"
1077 ;; Once installed, should uninstall with Guix
1078 "uninstall.py"))
1079 #t))))))
1080 (home-page "http://www.mcs.anl.gov/petsc")
1081 (synopsis "Library to solve PDEs")
1082 (description "PETSc, pronounced PET-see (the S is silent), is a suite of
1083 data structures and routines for the scalable (parallel) solution of
1084 scientific applications modeled by partial differential equations.")
1085 (license (license:non-copyleft
1086 "http://www.mcs.anl.gov/petsc/documentation/copyright.html"))))
1087
1088 (define-public petsc-complex
1089 (package (inherit petsc)
1090 (name "petsc-complex")
1091 (arguments
1092 (substitute-keyword-arguments (package-arguments petsc)
1093 ((#:configure-flags cf)
1094 `(cons "--with-scalar-type=complex" ,cf))))
1095 (synopsis "Library to solve PDEs (with complex scalars)")))
1096
1097 (define-public petsc-openmpi
1098 (package (inherit petsc)
1099 (name "petsc-openmpi")
1100 (inputs
1101 `(("openmpi" ,openmpi)
1102 ,@(package-inputs petsc)))
1103 (arguments
1104 (substitute-keyword-arguments (package-arguments petsc)
1105 ((#:configure-flags cf)
1106 ``("--with-mpiexec=mpirun"
1107 ,(string-append "--with-mpi-dir="
1108 (assoc-ref %build-inputs "openmpi"))
1109 ,@(delete "--with-mpi=0" ,cf)))))
1110 (synopsis "Library to solve PDEs (with MPI support)")))
1111
1112 (define-public petsc-complex-openmpi
1113 (package (inherit petsc-complex)
1114 (name "petsc-complex-openmpi")
1115 (inputs
1116 `(("openmpi" ,openmpi)
1117 ,@(package-inputs petsc-complex)))
1118 (arguments
1119 (substitute-keyword-arguments (package-arguments petsc-complex)
1120 ((#:configure-flags cf)
1121 ``("--with-mpiexec=mpirun"
1122 ,(string-append "--with-mpi-dir="
1123 (assoc-ref %build-inputs "openmpi"))
1124 ,@(delete "--with-mpi=0" ,cf)))))
1125 (synopsis "Library to solve PDEs (with complex scalars and MPI support)")))
1126
1127 (define-public slepc
1128 (package
1129 (name "slepc")
1130 (version "3.7.1")
1131 (source
1132 (origin
1133 (method url-fetch)
1134 (uri (string-append "http://slepc.upv.es/download/download.php?"
1135 "filename=slepc-" version ".tar.gz"))
1136 (file-name (string-append name "-" version ".tar.gz"))
1137 (sha256
1138 (base32
1139 "1hijlmrvxvfqslnx8yydzw5xqbsn1yy02g32w0hln1z3cgr1c0k7"))))
1140 (build-system gnu-build-system)
1141 (native-inputs
1142 `(("python" ,python-2)))
1143 (inputs
1144 `(("arpack" ,arpack-ng)
1145 ("gfortran" ,gfortran)))
1146 (propagated-inputs
1147 `(("petsc" ,petsc)))
1148 (arguments
1149 `(#:parallel-build? #f ;build is parallel by default
1150 #:configure-flags
1151 `(,(string-append "--with-arpack-dir="
1152 (assoc-ref %build-inputs "arpack") "/lib"))
1153 #:phases
1154 (modify-phases %standard-phases
1155 (replace 'configure
1156 ;; configure is a python script, so we can't run it with bash.
1157 (lambda* (#:key inputs outputs (configure-flags '())
1158 #:allow-other-keys)
1159 (let* ((prefix (assoc-ref outputs "out"))
1160 (flags `(,(string-append "--prefix=" prefix)
1161 ,@configure-flags)))
1162 (format #t "build directory: ~s~%" (getcwd))
1163 (format #t "configure flags: ~s~%" flags)
1164 (setenv "SLEPC_DIR" (getcwd))
1165 (setenv "PETSC_DIR" (assoc-ref inputs "petsc"))
1166 (zero? (apply system* "./configure" flags)))))
1167 (add-after 'install 'delete-doc
1168 ;; TODO: SLEPc installs HTML documentation alongside headers in
1169 ;; $out/include. We'd like to move them to share/doc, but delete
1170 ;; them for now, as they are incomplete and installing the complete
1171 ;; documentation is difficult.
1172 (lambda* (#:key outputs #:allow-other-keys)
1173 (let* ((out (assoc-ref outputs "out")))
1174 (for-each delete-file (find-files out "\\.html$")))))
1175 (add-after 'install 'clean-install
1176 ;; Clean up unnecessary build logs from installation.
1177 (lambda* (#:key outputs #:allow-other-keys)
1178 (let ((out (assoc-ref outputs "out")))
1179 (for-each (lambda (file)
1180 (let ((f (string-append out "/lib/slepc/conf/" file)))
1181 (when (file-exists? f)
1182 (delete-file f))))
1183 '("configure.log" "make.log" "gmake.log"
1184 "test.log" "error.log" "RDict.db"
1185 "uninstall.py"))))))))
1186 (home-page "http://slepc.upv.es")
1187 (synopsis "Scalable library for eigenproblems")
1188 (description "SLEPc is a software library for the solution of large sparse
1189 eigenproblems on parallel computers. It can be used for the solution of
1190 linear eigenvalue problems formulated in either standard or generalized form,
1191 as well as other related problems such as the singular value decomposition.
1192 The emphasis of the software is on methods and techniques appropriate for
1193 problems in which the associated matrices are sparse, for example, those
1194 arising after the discretization of partial differential equations.")
1195 (license license:lgpl3)))
1196
1197 (define-public slepc-complex
1198 (package (inherit slepc)
1199 (name "slepc-complex")
1200 (propagated-inputs
1201 `(("petsc" ,petsc-complex)
1202 ,@(alist-delete "petsc" (package-propagated-inputs slepc))))
1203 (synopsis "Scalable library for eigenproblems (with complex scalars)")))
1204
1205 (define-public slepc-openmpi
1206 (package (inherit slepc)
1207 (name "slepc-openmpi")
1208 (inputs
1209 `(("mpi" ,openmpi)
1210 ("arpack" ,arpack-ng-openmpi)
1211 ,@(alist-delete "arpack" (package-inputs slepc))))
1212 (propagated-inputs
1213 `(("petsc" ,petsc-openmpi)
1214 ,@(alist-delete "petsc" (package-propagated-inputs slepc))))
1215 (synopsis "Scalable library for eigenproblems (with MPI support)")))
1216
1217 (define-public slepc-complex-openmpi
1218 (package (inherit slepc-openmpi)
1219 (name "slepc-complex-openmpi")
1220 (propagated-inputs
1221 `(("petsc" ,petsc-complex-openmpi)
1222 ,@(alist-delete "petsc" (package-propagated-inputs slepc-openmpi))))
1223 (synopsis "Scalable library for eigenproblems (with complex scalars and MPI support)")))
1224
1225 (define-public mumps
1226 (package
1227 (name "mumps")
1228 (version "5.0.2")
1229 (source
1230 (origin
1231 (method url-fetch)
1232 (uri (string-append "http://mumps.enseeiht.fr/MUMPS_"
1233 version ".tar.gz"))
1234 (sha256
1235 (base32
1236 "0igyc1pfzxdhpbad3v3lb86ixkdbqa1a8gbs15b04r2294h2nabp"))
1237 (patches (search-patches "mumps-build-parallelism.patch"))))
1238 (build-system gnu-build-system)
1239 (inputs
1240 `(("fortran" ,gfortran)
1241 ;; These are required for linking against mumps, but we let the user
1242 ;; declare the dependency.
1243 ("blas" ,openblas)
1244 ("metis" ,metis)
1245 ("scotch" ,scotch)))
1246 (arguments
1247 `(#:modules ((ice-9 match)
1248 (ice-9 popen)
1249 (srfi srfi-1)
1250 ,@%gnu-build-system-modules)
1251 #:phases
1252 (modify-phases %standard-phases
1253 (replace 'configure
1254 (lambda* (#:key inputs #:allow-other-keys)
1255 (call-with-output-file "Makefile.inc"
1256 (lambda (port)
1257 (format port "
1258 PLAT =
1259 LIBEXT = .a
1260 OUTC = -o
1261 OUTF = -o
1262 RM = rm -f~:[
1263 CC = gcc
1264 FC = gfortran
1265 FL = gfortran
1266 INCSEQ = -I$(topdir)/libseq
1267 LIBSEQ = -L$(topdir)/libseq -lmpiseq
1268 LIBSEQNEEDED = libseqneeded~;
1269 CC = mpicc
1270 FC = mpifort
1271 FL = mpifort~]
1272 AR = ar vr # rules require trailing space, ugh...
1273 RANLIB = ranlib
1274 LIBBLAS = -L~a -lopenblas~@[
1275 SCALAP = -L~a -lscalapack~]
1276 LIBOTHERS = -pthread
1277 CDEFS = -DAdd_
1278 PIC = -fPIC
1279 OPTF = -O2 -DALLOW_NON_INIT $(PIC)
1280 OPTL = -O2 $(PIC)
1281 OPTC = -O2 $(PIC)
1282 INCS = $(INCSEQ)
1283 LIBS = $(SCALAP) $(LIBSEQ)
1284 LPORDDIR = $(topdir)/PORD/lib
1285 IPORD = -I$(topdir)/PORD/include
1286 LPORD = -L$(LPORDDIR) -lpord
1287 ORDERINGSF = -Dpord~@[
1288 METISDIR = ~a
1289 IMETIS = -I$(METISDIR)/include
1290 LMETIS = -L$(METISDIR)/lib -lmetis
1291 ORDERINGSF += -Dmetis~]~@[~:{
1292 SCOTCHDIR = ~a
1293 ISCOTCH = -I$(SCOTCHDIR)/include
1294 LSCOTCH = -L$(SCOTCHDIR)/lib ~a-lesmumps -lscotch -lscotcherr
1295 ORDERINGSF += ~a~}~]
1296 ORDERINGSC = $(ORDERINGSF)
1297 LORDERINGS = $(LPORD) $(LMETIS) $(LSCOTCH)
1298 IORDERINGSF = $(ISCOTCH)
1299 IORDERINGSC = $(IPORD) $(IMETIS) $(ISCOTCH)"
1300 (assoc-ref inputs "mpi")
1301 (assoc-ref inputs "blas")
1302 (assoc-ref inputs "scalapack")
1303 (assoc-ref inputs "metis")
1304 (match (list (assoc-ref inputs "pt-scotch")
1305 (assoc-ref inputs "scotch"))
1306 ((#f #f)
1307 #f)
1308 ((#f scotch)
1309 `((,scotch "" "-Dscotch")))
1310 ((ptscotch _)
1311 `((,ptscotch
1312 "-lptesmumps -lptscotch -lptscotcherr "
1313 "-Dptscotch")))))))))
1314 (replace 'build
1315 ;; By default only the d-precision library is built. Make with "all"
1316 ;; target so that all precision libraries and examples are built.
1317 (lambda _
1318 (zero? (system* "make" "all"
1319 (format #f "-j~a" (parallel-job-count))))))
1320 (replace 'check
1321 ;; Run the simple test drivers, which read test input from stdin:
1322 ;; from the "real" input for the single- and double-precision
1323 ;; testers, and from the "cmplx" input for complex-precision
1324 ;; testers. The EXEC-PREFIX key is used by the mumps-openmpi
1325 ;; package to prefix execution with "mpirun".
1326 (lambda* (#:key (exec-prefix '()) #:allow-other-keys)
1327 (with-directory-excursion "examples"
1328 (every
1329 (lambda (prec type)
1330 (let ((tester (apply open-pipe*
1331 `(,OPEN_WRITE
1332 ,@exec-prefix
1333 ,(string-append "./" prec
1334 "simpletest"))))
1335 (input (open-input-file
1336 (string-append "input_simpletest_" type))))
1337 (begin
1338 (dump-port input tester)
1339 (close-port input)
1340 (zero? (close-pipe tester)))))
1341 '("s" "d" "c" "z")
1342 '("real" "real" "cmplx" "cmplx")))))
1343 (replace 'install
1344 (lambda* (#:key outputs #:allow-other-keys)
1345 (let* ((out (assoc-ref outputs "out"))
1346 (libdir (string-append out "/lib")))
1347 (copy-recursively "lib" libdir)
1348 (copy-recursively "include" (string-append out "/include"))
1349 (when (file-exists? "libseq/libmpiseq.a")
1350 (install-file "libseq/libmpiseq.a" libdir))
1351 #t))))))
1352 (home-page "http://mumps.enseeiht.fr")
1353 (synopsis "Multifrontal sparse direct solver")
1354 (description
1355 "MUMPS (MUltifrontal Massively Parallel sparse direct Solver) solves a
1356 sparse system of linear equations A x = b using Guassian elimination.")
1357 (license license:cecill-c)))
1358
1359 (define-public mumps-metis
1360 (package (inherit mumps)
1361 (name "mumps-metis")
1362 (inputs
1363 (alist-delete "scotch" (package-inputs mumps)))))
1364
1365 (define-public mumps-openmpi
1366 (package (inherit mumps)
1367 (name "mumps-openmpi")
1368 (inputs
1369 `(("mpi" ,openmpi)
1370 ("scalapack" ,scalapack)
1371 ("pt-scotch" ,pt-scotch)
1372 ,@(alist-delete "scotch" (package-inputs mumps))))
1373 (arguments
1374 (substitute-keyword-arguments (package-arguments mumps)
1375 ((#:phases phases)
1376 `(modify-phases ,phases
1377 (replace
1378 'check
1379 (lambda _
1380 ((assoc-ref ,phases 'check)
1381 #:exec-prefix '("mpirun" "-n" "2"))))))))
1382 (synopsis "Multifrontal sparse direct solver (with MPI)")))
1383
1384 (define-public mumps-metis-openmpi
1385 (package (inherit mumps-openmpi)
1386 (name "mumps-metis-openmpi")
1387 (inputs
1388 (alist-delete "pt-scotch" (package-inputs mumps-openmpi)))))
1389
1390 (define-public r-quadprog
1391 (package
1392 (name "r-quadprog")
1393 (version "1.5-5")
1394 (source
1395 (origin
1396 (method url-fetch)
1397 (uri (cran-uri "quadprog" version))
1398 (sha256
1399 (base32
1400 "0jg3r6abmhp8r9vkbhpx9ldjfw6vyl1m4c5vwlyjhk1mi03656fr"))))
1401 (build-system r-build-system)
1402 (native-inputs
1403 `(("gfortran" ,gfortran)))
1404 (home-page "http://cran.r-project.org/web/packages/quadprog")
1405 (synopsis "Functions to solve quadratic programming problems")
1406 (description
1407 "This package contains routines and documentation for solving quadratic
1408 programming problems.")
1409 (license license:gpl3+)))
1410
1411 (define-public r-pracma
1412 (package
1413 (name "r-pracma")
1414 (version "1.9.5")
1415 (source (origin
1416 (method url-fetch)
1417 (uri (cran-uri "pracma" version))
1418 (sha256
1419 (base32 "19nr2jlkbcdgvw3gx5hry12av565lmvqd5q4h7zlch3q13avwwl2"))))
1420 (build-system r-build-system)
1421 (propagated-inputs
1422 `(("r-quadprog" ,r-quadprog)))
1423 (home-page "http://cran.r-project.org/web/packages/pracma")
1424 (synopsis "Practical numerical math functions")
1425 (description "This package provides functions for numerical analysis and
1426 linear algebra, numerical optimization, differential equations, plus some
1427 special functions. It uses Matlab function names where appropriate to simplify
1428 porting.")
1429 (license license:gpl3+)))
1430
1431 (define-public superlu
1432 (package
1433 (name "superlu")
1434 (version "5.2.1")
1435 (source
1436 (origin
1437 (method url-fetch)
1438 (uri (string-append "http://crd-legacy.lbl.gov/~xiaoye/SuperLU/"
1439 "superlu_" version ".tar.gz"))
1440 (sha256
1441 (base32 "0qzlb7cd608q62kyppd0a8c65l03vrwqql6gsm465rky23b6dyr8"))
1442 (modules '((guix build utils)))
1443 (snippet
1444 ;; Replace the non-free implementation of MC64 with a stub adapted
1445 ;; from Debian
1446 '(begin
1447 (use-modules (ice-9 regex)
1448 (ice-9 rdelim))
1449 (call-with-output-file "SRC/mc64ad.c"
1450 (lambda (port)
1451 (display "
1452 #include <stdio.h>
1453 #include <stdlib.h>
1454 void mc64id_(int *a) {
1455 fprintf (stderr, \"SuperLU: non-free MC64 not available. Aborting.\\n\");
1456 abort ();
1457 }
1458 void mc64ad_ (int *a, int *b, int *c, int *d, int *e, double *f, int *g,
1459 int *h, int *i, int *j, int *k, double *l, int *m, int *n) {
1460 fprintf (stderr, \"SuperLU: non-free MC64 not available. Aborting.\\n\");
1461 abort ();
1462 }\n" port)))
1463 ;; Remove the corresponding license verbiage. MC64 license follows
1464 ;; a "------" line separator.
1465 (with-atomic-file-replacement "License.txt"
1466 (let ((rx (make-regexp "-{8}")))
1467 (lambda (in out)
1468 (let loop ()
1469 (let ((line (read-line in 'concat)))
1470 (unless (regexp-exec rx line)
1471 (display line out)
1472 (loop)))))))))))
1473 (build-system cmake-build-system)
1474 (native-inputs
1475 `(("tcsh" ,tcsh)))
1476 (inputs
1477 `(("blas" ,openblas)
1478 ("gfortran" ,gfortran)))
1479 (arguments
1480 `(#:configure-flags '("-Denable_blaslib:BOOL=NO" ;do not use internal cblas
1481 "-DTPL_BLAS_LIBRARIES=openblas"
1482 "-DBUILD_SHARED_LIBS:BOOL=YES"
1483 "-DCMAKE_INSTALL_LIBDIR=lib")))
1484 (home-page "http://crd-legacy.lbl.gov/~xiaoye/SuperLU/")
1485 (synopsis "Supernodal direct solver for sparse linear systems")
1486 (description
1487 "SuperLU is a general purpose library for the direct solution of large,
1488 sparse, nonsymmetric systems of linear equations on high performance machines.
1489 The library is written in C and is callable from either C or Fortran. The
1490 library routines perform an LU decomposition with partial pivoting and
1491 triangular system solves through forward and back substitution. The library
1492 also provides threshold-based ILU factorization preconditioners.")
1493 (license (list license:bsd-3
1494 license:gpl2+ ;EXAMPLE/*fgmr.c
1495 (license:fsf-free "file://SRC/colamd.h")))))
1496
1497 (define-public superlu-dist
1498 (package
1499 (name "superlu-dist")
1500 (version "3.3")
1501 (source
1502 (origin
1503 (method url-fetch)
1504 (uri (string-append "http://crd-legacy.lbl.gov/~xiaoye/SuperLU/"
1505 "superlu_dist_" version ".tar.gz"))
1506 (sha256
1507 (base32 "1hnak09yxxp026blq8zhrl7685yip16svwngh1wysqxf8z48vzfj"))
1508 (modules '((guix build utils)))
1509 (snippet
1510 ;; Replace the non-free implementation of MC64 with a stub
1511 '(begin
1512 (use-modules (ice-9 regex)
1513 (ice-9 rdelim))
1514 (call-with-output-file "SRC/mc64ad.c"
1515 (lambda (port)
1516 (display "
1517 #include <stdio.h>
1518 #include <stdlib.h>
1519 void mc64id_(int *a) {
1520 fprintf (stderr, \"SuperLU_DIST: non-free MC64 not available. Aborting.\\n\");
1521 abort ();
1522 }
1523 void mc64ad_ (int *a, int *b, int *c, int *d, int *e, double *f, int *g,
1524 int *h, int *i, int *j, int *k, double *l, int *m, int *n) {
1525 fprintf (stderr, \"SuperLU_DIST: non-free MC64 not available. Aborting.\\n\");
1526 abort ();
1527 }\n" port)))
1528 (delete-file "SRC/mc64ad.f.bak")
1529 (substitute* "SRC/util.c" ;adjust default algorithm
1530 (("RowPerm[[:blank:]]*=[[:blank:]]*LargeDiag")
1531 "RowPerm = NOROWPERM"))))
1532 (patches (search-patches "superlu-dist-scotchmetis.patch"))))
1533 (build-system gnu-build-system)
1534 (native-inputs
1535 `(("tcsh" ,tcsh)))
1536 (inputs
1537 `(("gfortran" ,gfortran)))
1538 (propagated-inputs
1539 `(("openmpi" ,openmpi) ;headers include MPI heades
1540 ("lapack" ,lapack) ;required to link with output library
1541 ("pt-scotch" ,pt-scotch))) ;same
1542 (arguments
1543 `(#:parallel-build? #f ;race conditions using ar
1544 #:phases
1545 (alist-replace
1546 'configure
1547 (lambda* (#:key inputs outputs #:allow-other-keys)
1548 (call-with-output-file "make.inc"
1549 (lambda (port)
1550 (format port "
1551 PLAT =
1552 DSuperLUroot = ~a
1553 DSUPERLULIB = ~a/lib/libsuperlu_dist.a
1554 BLASDEF = -DUSE_VENDOR_BLAS
1555 BLASLIB = -L~a/lib -lblas
1556 PARMETISLIB = -L~a/lib \
1557 -lptscotchparmetis -lptscotch -lptscotcherr -lptscotcherrexit \
1558 -lscotch -lscotcherr -lscotcherrexit
1559 METISLIB = -L~:*~a/lib \
1560 -lscotchmetis -lscotch -lscotcherr -lscotcherrexit
1561 LIBS = $(DSUPERLULIB) $(PARMETISLIB) $(METISLIB) $(BLASLIB)
1562 ARCH = ar
1563 ARCHFLAGS = cr
1564 RANLIB = ranlib
1565 CC = mpicc
1566 PIC = -fPIC
1567 CFLAGS = -O3 -g -DPRNTlevel=0 $(PIC)
1568 NOOPTS = -O0 -g $(PIC)
1569 FORTRAN = mpifort
1570 FFLAGS = -O2 -g $(PIC)
1571 LOADER = $(CC)
1572 CDEFS = -DAdd_"
1573 (getcwd)
1574 (assoc-ref outputs "out")
1575 (assoc-ref inputs "lapack")
1576 (assoc-ref inputs "pt-scotch")))))
1577 (alist-cons-after
1578 'unpack 'remove-broken-symlinks
1579 (lambda _
1580 (for-each delete-file
1581 (find-files "MAKE_INC" "\\.#make\\..*")))
1582 (alist-cons-before
1583 'build 'create-install-directories
1584 (lambda* (#:key outputs #:allow-other-keys)
1585 (for-each
1586 (lambda (dir)
1587 (mkdir-p (string-append (assoc-ref outputs "out")
1588 "/" dir)))
1589 '("lib" "include")))
1590 (alist-replace
1591 'check
1592 (lambda _
1593 (with-directory-excursion "EXAMPLE"
1594 (and
1595 (zero? (system* "mpirun" "-n" "2"
1596 "./pddrive" "-r" "1" "-c" "2" "g20.rua"))
1597 (zero? (system* "mpirun" "-n" "2"
1598 "./pzdrive" "-r" "1" "-c" "2" "cg20.cua")))))
1599 (alist-replace
1600 'install
1601 (lambda* (#:key outputs #:allow-other-keys)
1602 ;; Library is placed in lib during the build phase. Copy over
1603 ;; headers to include.
1604 (let* ((out (assoc-ref outputs "out"))
1605 (incdir (string-append out "/include")))
1606 (for-each (lambda (file)
1607 (let ((base (basename file)))
1608 (format #t "installing `~a' to `~a'~%"
1609 base incdir)
1610 (copy-file file
1611 (string-append incdir "/" base))))
1612 (find-files "SRC" ".*\\.h$"))))
1613 %standard-phases)))))))
1614 (home-page (package-home-page superlu))
1615 (synopsis "Parallel supernodal direct solver")
1616 (description
1617 "SuperLU_DIST is a parallel extension to the serial SuperLU library.
1618 It is targeted for distributed memory parallel machines. SuperLU_DIST is
1619 implemented in ANSI C, and MPI for communications.")
1620 (license license:bsd-3)))
1621
1622 (define-public scotch
1623 (package
1624 (name "scotch")
1625 (version "6.0.4")
1626 (source
1627 (origin
1628 (method url-fetch)
1629 (uri (string-append "https://gforge.inria.fr/frs/download.php/34618/"
1630 "scotch_" version ".tar.gz"))
1631 (sha256
1632 (base32 "1ir088mvrqggyqdkx9qfynmiaffqbyih5qfl5mga2nrlm1qlsgzm"))
1633 (patches (search-patches "scotch-test-threading.patch"
1634 "pt-scotch-build-parallelism.patch"))))
1635 (build-system gnu-build-system)
1636 (inputs
1637 `(("zlib" ,zlib)
1638 ("flex" ,flex)
1639 ("bison" ,bison)))
1640 (arguments
1641 `(#:phases
1642 (modify-phases %standard-phases
1643 (add-after
1644 'unpack 'chdir-to-src
1645 (lambda _ (chdir "src")))
1646 (replace
1647 'configure
1648 (lambda _
1649 (call-with-output-file "Makefile.inc"
1650 (lambda (port)
1651 (format port "
1652 EXE =
1653 LIB = .a
1654 OBJ = .o
1655 MAKE = make
1656 AR = ar
1657 ARFLAGS = -ruv
1658 CAT = cat
1659 CCS = gcc
1660 CCP = mpicc
1661 CCD = gcc
1662 CPPFLAGS =~{ -D~a~}
1663 CFLAGS = -O2 -g -fPIC $(CPPFLAGS)
1664 LDFLAGS = -lz -lm -lrt -lpthread
1665 CP = cp
1666 LEX = flex -Pscotchyy -olex.yy.c
1667 LN = ln
1668 MKDIR = mkdir
1669 MV = mv
1670 RANLIB = ranlib
1671 YACC = bison -pscotchyy -y -b y
1672 "
1673 '("COMMON_FILE_COMPRESS_GZ"
1674 "COMMON_PTHREAD"
1675 "COMMON_RANDOM_FIXED_SEED"
1676 ;; Prevents symbolc clashes with libesmumps
1677 "SCOTCH_RENAME"
1678 ;; XXX: Causes invalid frees in superlu-dist tests
1679 ;; "SCOTCH_PTHREAD"
1680 ;; "SCOTCH_PTHREAD_NUMBER=2"
1681 "restrict=__restrict"))))))
1682 (add-after
1683 'build 'build-esmumps
1684 (lambda _
1685 (zero? (system* "make"
1686 (format #f "-j~a" (parallel-job-count))
1687 "esmumps"))))
1688 (replace
1689 'install
1690 (lambda* (#:key outputs #:allow-other-keys)
1691 (let ((out (assoc-ref outputs "out")))
1692 (mkdir out)
1693 (zero? (system* "make"
1694 (string-append "prefix=" out)
1695 "install"))
1696 ;; esmumps files are not installed with the above
1697 (for-each (lambda (f)
1698 (copy-file f (string-append out "/include/" f)))
1699 (find-files "../include" ".*esmumps.h$"))
1700 (for-each (lambda (f)
1701 (copy-file f (string-append out "/lib/" f)))
1702 (find-files "../lib" "^lib.*esmumps.*"))))))))
1703 (home-page "http://www.labri.fr/perso/pelegrin/scotch/")
1704 (synopsis "Programs and libraries for graph algorithms")
1705 (description "SCOTCH is a set of programs and libraries which implement
1706 the static mapping and sparse matrix reordering algorithms developed within
1707 the SCOTCH project. Its purpose is to apply graph theory, with a divide and
1708 conquer approach, to scientific computing problems such as graph and mesh
1709 partitioning, static mapping, and sparse matrix ordering, in application
1710 domains ranging from structural mechanics to operating systems or
1711 bio-chemistry.")
1712 ;; See LICENSE_en.txt
1713 (license license:cecill-c)))
1714
1715 (define-public pt-scotch
1716 (package (inherit scotch)
1717 (name "pt-scotch")
1718 (propagated-inputs
1719 `(("openmpi" ,openmpi))) ;Headers include MPI headers
1720 (arguments
1721 (substitute-keyword-arguments (package-arguments scotch)
1722 ((#:phases scotch-phases)
1723 `(modify-phases ,scotch-phases
1724 (replace
1725 'build
1726 (lambda _
1727 (and
1728 (zero? (system* "make"
1729 (format #f "-j~a" (parallel-job-count))
1730 "ptscotch" "ptesmumps"))
1731 ;; Install the serial metis compatibility library
1732 (zero? (system* "make" "-C" "libscotchmetis" "install")))))
1733 (replace
1734 'check
1735 (lambda _ (zero? (system* "make" "ptcheck"))))))))
1736 (synopsis "Programs and libraries for graph algorithms (with MPI)")))
1737
1738 (define-public metis
1739 (package
1740 (name "metis")
1741 (version "5.1.0")
1742 (source
1743 (origin
1744 (method url-fetch)
1745 (uri (string-append "http://glaros.dtc.umn.edu/gkhome/fetch/sw/metis/"
1746 "metis-" version ".tar.gz"))
1747 (sha256
1748 (base32
1749 "1cjxgh41r8k6j029yxs8msp3z6lcnpm16g5pvckk35kc7zhfpykn"))))
1750 (build-system cmake-build-system)
1751 (inputs
1752 `(("blas" ,openblas)))
1753 (arguments
1754 `(#:tests? #f ;no tests
1755 #:configure-flags `("-DSHARED=ON"
1756 ,(string-append "-DGKLIB_PATH=" (getcwd)
1757 "/metis-" ,version "/GKlib"))))
1758 (home-page "http://glaros.dtc.umn.edu/gkhome/metis/metis/overview")
1759 (synopsis "Graph partitioning and fill-reducing matrix ordering library")
1760 (description
1761 "METIS is a set of serial programs for partitioning graphs, partitioning
1762 finite element meshes, and producing fill-reducing orderings for sparse
1763 matrices. The algorithms implemented in METIS are based on the multilevel
1764 recursive-bisection, multilevel k-way, and multi-constraint partitioning
1765 schemes.")
1766 (license license:asl2.0))) ;As of version 5.0.3
1767
1768 (define-public p4est
1769 (package
1770 (name "p4est")
1771 (version "1.1")
1772 (source
1773 (origin
1774 (method url-fetch)
1775 (uri (string-append "http://p4est.github.io/release/p4est-"
1776 version ".tar.gz"))
1777 (sha256
1778 (base32
1779 "0faina2h5qsx3m2izbzaj9bbakma1krbbjmq43wrp1hcbyijflqb"))))
1780 (build-system gnu-build-system)
1781 (inputs
1782 `(("fortran" ,gfortran)
1783 ("blas" ,openblas)
1784 ("lapack" ,lapack)
1785 ("zlib" ,zlib)))
1786 (arguments
1787 `(#:configure-flags `(,(string-append "BLAS_LIBS=-L"
1788 (assoc-ref %build-inputs "blas")
1789 " -lopenblas")
1790 ,(string-append "LAPACK_LIBS=-L"
1791 (assoc-ref %build-inputs "lapack")
1792 " -llapack"))))
1793 (home-page "http://www.p4est.org")
1794 (synopsis "Adaptive mesh refinement on forests of octrees")
1795 (description
1796 "The p4est software library enables the dynamic management of a
1797 collection of adaptive octrees, conveniently called a forest of octrees.
1798 p4est is designed to work in parallel and scales to hundreds of thousands of
1799 processor cores.")
1800 (license license:gpl2+)))
1801
1802 (define-public p4est-openmpi
1803 (package (inherit p4est)
1804 (name "p4est-openmpi")
1805 (inputs
1806 `(("mpi" ,openmpi)
1807 ,@(package-inputs p4est)))
1808 (arguments
1809 (substitute-keyword-arguments (package-arguments p4est)
1810 ((#:configure-flags cf)
1811 ``("--enable-mpi" ,@,cf))))
1812 (synopsis "Parallel adaptive mesh refinement on forests of octrees")))
1813
1814 (define-public gsegrafix
1815 (package
1816 (name "gsegrafix")
1817 (version "1.0.6")
1818 (source
1819 (origin
1820 (method url-fetch)
1821 (uri (string-append "mirror://gnu/" name "/" name "-"
1822 version ".tar.gz"))
1823 (sha256
1824 (base32
1825 "1b13hvx063zv970y750bx41wpx6hwd5ngjhbdrna8w8yy5kmxcda"))))
1826 (build-system gnu-build-system)
1827 (arguments
1828 `(#:configure-flags '("LDFLAGS=-lm")))
1829 (inputs
1830 `(("libgnomecanvas" ,libgnomecanvas)
1831 ("libbonoboui" ,libbonoboui)
1832 ("libgnomeui" ,libgnomeui)
1833 ("libgnomeprintui" ,libgnomeprintui)
1834 ("popt" ,popt)))
1835 (native-inputs
1836 `(("pkg-config" ,pkg-config)))
1837 (home-page "http://www.gnu.org/software/gsegrafix/")
1838 (synopsis "GNOME application to create scientific and engineering plots")
1839 (description "GSEGrafix is an application which produces high-quality graphical
1840 plots for science and engineering. Plots are specified via simple ASCII
1841 parameter files and data files and are presented in an anti-aliased GNOME
1842 canvas. The program supports rectangular two-dimensional plots, histograms,
1843 polar-axis plots and three-dimensional plots. Plots can be printed or saved
1844 to BMP, JPEG or PNG image formats.")
1845 (license license:gpl3+)))
1846
1847 (define-public maxima
1848 (package
1849 (name "maxima")
1850 (version "5.38.1")
1851 (source
1852 (origin
1853 (method url-fetch)
1854 (uri (string-append "mirror://sourceforge/maxima/Maxima-source/"
1855 version "-source/" name "-" version ".tar.gz"))
1856 (sha256
1857 (base32
1858 "1p6646rvq43hk09msyp0dk50cqpkh07mf4x0bc2fqisqmcv6b1hf"))
1859 (patches (search-patches "maxima-defsystem-mkdir.patch"))))
1860 (build-system gnu-build-system)
1861 (inputs
1862 `(("gcl" ,gcl)
1863 ("gnuplot" ,gnuplot) ;for plots
1864 ("tk" ,tk))) ;Tcl/Tk is used by 'xmaxima'
1865 (native-inputs
1866 `(("texinfo" ,texinfo)
1867 ("perl" ,perl)
1868 ("python" ,python)))
1869 (arguments
1870 `(#:configure-flags
1871 (list "--enable-gcl"
1872 (string-append "--with-posix-shell="
1873 (assoc-ref %build-inputs "bash")
1874 "/bin/sh")
1875 (string-append "--with-wish="
1876 (assoc-ref %build-inputs "tk")
1877 "/bin/wish"
1878 (let ((v ,(package-version tk)))
1879 (string-take v (string-index-right v #\.)))))
1880 ;; By default Maxima attempts to write temporary files to
1881 ;; '/tmp/nix-build-maxima-*', which won't exist at run time.
1882 ;; Work around that.
1883 #:make-flags (list "TMPDIR=/tmp")
1884 #:phases (alist-cons-before
1885 'check 'pre-check
1886 (lambda _
1887 (chmod "src/maxima" #o555))
1888 ;; Make sure the doc and emacs files are found in the
1889 ;; standard location. Also configure maxima to find gnuplot
1890 ;; without having it on the PATH.
1891 (alist-cons-after
1892 'install 'post-install
1893 (lambda* (#:key outputs inputs #:allow-other-keys)
1894 (let* ((gnuplot (assoc-ref inputs "gnuplot"))
1895 (out (assoc-ref outputs "out"))
1896 (datadir (string-append out "/share/maxima/" ,version)))
1897 (with-directory-excursion out
1898 (mkdir-p "share/emacs")
1899 (mkdir-p "share/doc")
1900 (symlink
1901 (string-append datadir "/emacs/")
1902 (string-append out "/share/emacs/site-lisp"))
1903 (symlink
1904 (string-append datadir "/doc/")
1905 (string-append out "/share/doc/maxima"))
1906 (with-atomic-file-replacement
1907 (string-append datadir "/share/maxima-init.lisp")
1908 (lambda (in out)
1909 (format out "~a ~s~a~%"
1910 "(setf $gnuplot_command "
1911 (string-append gnuplot "/bin/gnuplot") ")")
1912 (dump-port in out))))))
1913 %standard-phases))))
1914 (home-page "http://maxima.sourceforge.net")
1915 (synopsis "Numeric and symbolic expression manipulation")
1916 (description "Maxima is a system for the manipulation of symbolic and
1917 numerical expressions. It yields high precision numeric results by using
1918 exact fractions, arbitrary precision integers, and variable precision floating
1919 point numbers.")
1920 ;; Some files are lgpl2.1+. Some are gpl2+. Some explicitly state gpl1+.
1921 ;; Others simply say "GNU General Public License" without stating a
1922 ;; version (which implicitly means gpl1+).
1923 ;; At least one file (src/maxima.asd) says "version 2."
1924 ;; GPLv2 only is therefore the smallest subset.
1925 (license license:gpl2)))
1926
1927 (define-public wxmaxima
1928 (package
1929 (name "wxmaxima")
1930 (version "16.04.2")
1931 (source
1932 (origin
1933 (method url-fetch)
1934 (uri (string-append "mirror://sourceforge/wxmaxima/wxMaxima/"
1935 version "/" name "-" version ".tar.gz"))
1936 (sha256
1937 (base32
1938 "1fpqzk1921isiqrpgpf433ldq41924qs9sy99fl1zn5661b2l73n"))))
1939 (build-system gnu-build-system)
1940 (inputs
1941 `(("wxwidgets" ,wxwidgets)
1942 ("maxima" ,maxima)
1943 ;; Runtime support.
1944 ("adwaita-icon-theme" ,adwaita-icon-theme)
1945 ("gtk+" ,gtk+)
1946 ("shared-mime-info" ,shared-mime-info)))
1947 (arguments
1948 `(#:phases (modify-phases %standard-phases
1949 (add-after
1950 'install 'wrap-program
1951 (lambda* (#:key inputs outputs #:allow-other-keys)
1952 (wrap-program (string-append (assoc-ref outputs "out")
1953 "/bin/wxmaxima")
1954 `("PATH" ":" prefix
1955 (,(string-append (assoc-ref inputs "maxima")
1956 "/bin")))
1957 ;; For GtkFileChooserDialog.
1958 `("GSETTINGS_SCHEMA_DIR" =
1959 (,(string-append (assoc-ref inputs "gtk+")
1960 "/share/glib-2.0/schemas")))
1961 `("XDG_DATA_DIRS" ":" prefix
1962 (;; Needed by gdk-pixbuf to know supported icon formats.
1963 ,(string-append
1964 (assoc-ref inputs "shared-mime-info") "/share")
1965 ;; The default icon theme of GTK+.
1966 ,(string-append
1967 (assoc-ref inputs "adwaita-icon-theme") "/share"))))
1968 #t)))))
1969 (home-page "https://andrejv.github.io/wxmaxima/")
1970 (synopsis "Graphical user interface for the Maxima computer algebra system")
1971 (description
1972 "wxMaxima is a graphical user interface for the Maxima computer algebra
1973 system. It eases the use of Maxima by making most of its commands available
1974 through a menu system and by providing input dialogs for commands that require
1975 more than one argument. It also implements its own display engine that
1976 outputs mathematical symbols directly instead of depicting them with ASCII
1977 characters.
1978
1979 wxMaxima also features 2D and 3D inline plots, simple animations, mixing of
1980 text and mathematical calculations to create documents, exporting of input and
1981 output to TeX, and a browser for Maxima's manual including command index and
1982 full text searching.")
1983 (license license:gpl2+)))
1984
1985 (define-public armadillo
1986 (package
1987 (name "armadillo")
1988 (version "7.500.0")
1989 (source (origin
1990 (method url-fetch)
1991 (uri (string-append "mirror://sourceforge/arma/armadillo-"
1992 version ".tar.xz"))
1993 (sha256
1994 (base32
1995 "1x98d32cgxbzbbma2ak6c37wnbpq13xxyxyd6jjvflv748mzi9ks"))))
1996 (build-system cmake-build-system)
1997 (arguments `(#:tests? #f)) ;no test target
1998 (inputs
1999 `(("openblas" ,openblas)
2000 ("lapack" ,lapack)
2001 ("arpack" ,arpack-ng)))
2002 (home-page "http://arma.sourceforge.net/")
2003 (synopsis "C++ linear algebra library")
2004 (description
2005 "Armadillo is a C++ linear algebra library, aiming towards a good balance
2006 between speed and ease of use. It is useful for algorithm development
2007 directly in C++, or quick conversion of research code into production
2008 environments. It can be used for machine learning, pattern recognition,
2009 signal processing, bioinformatics, statistics, econometrics, etc. The library
2010 provides efficient classes for vectors, matrices and cubes, as well as 150+
2011 associated functions (eg. contiguous and non-contiguous submatrix views).")
2012 (license license:mpl2.0)))
2013
2014 (define-public armadillo-for-rcpparmadillo
2015 (package (inherit armadillo)
2016 (version "7.500.0")
2017 (source (origin
2018 (method url-fetch)
2019 (uri (string-append "mirror://sourceforge/arma/armadillo-"
2020 version ".tar.xz"))
2021 (sha256
2022 (base32
2023 "1x98d32cgxbzbbma2ak6c37wnbpq13xxyxyd6jjvflv748mzi9ks"))))))
2024
2025 (define-public muparser
2026 ;; When switching download sites, muparser re-issued a 2.2.5 release with a
2027 ;; different hash. In order to make `guix package --upgrade` work correctly,
2028 ;; we set a Guix packaging revision.
2029 ;; When the next version of muparser is released, we can remove
2030 ;; UPSTREAM-VERSION and REVISION and use the plain VERSION.
2031 (let ((upstream-version "2.2.5")
2032 (revision "2"))
2033 (package
2034 (name "muparser")
2035 (version (string-append upstream-version "-" revision))
2036 (source
2037 (origin
2038 (method url-fetch)
2039 (uri (string-append "https://github.com/beltoforion/muparser/archive/v"
2040 upstream-version ".tar.gz"))
2041 (file-name (string-append name "-" version ".tar.gz"))
2042 (sha256
2043 (base32
2044 "0277qsi5l23jsck1vhn383bmvc2n9l4a1dl5r9bf7hvjv9ayyrh6"))))
2045 (build-system gnu-build-system)
2046 (arguments
2047 `(#:configure-flags '("--enable-samples=no")
2048 #:tests? #f)) ;no "check" target
2049 (home-page "http://muparser.beltoforion.de/")
2050 (synopsis "Fast parser library for mathematical expressions")
2051 (description
2052 "muParser is an extensible high performance math parser library. It is
2053 based on transforming an expression into a bytecode and precalculating constant
2054 parts of it.")
2055 (license license:expat))))
2056
2057 (define-public openblas
2058 (package
2059 (name "openblas")
2060 (version "0.2.15")
2061 (source
2062 (origin
2063 (method url-fetch)
2064 (uri (string-append "https://github.com/xianyi/OpenBLAS/tarball/v"
2065 version))
2066 (file-name (string-append name "-" version ".tar.gz"))
2067 (sha256
2068 (base32
2069 "1k5f6vjlk54qlplk5m7xkbaw6g2y7dl50lwwdv6xsbcsgsbxfcpy"))))
2070 (build-system gnu-build-system)
2071 (arguments
2072 `(#:tests? #f ;no "check" target
2073 ;; DYNAMIC_ARCH is only supported on x86. When it is disabled and no
2074 ;; TARGET is specified, OpenBLAS will tune itself to the build host, so
2075 ;; we need to disable substitutions.
2076 #:substitutable?
2077 ,(let ((system (or (%current-target-system) (%current-system))))
2078 (or (string-prefix? "x86_64" system)
2079 (string-prefix? "i686" system)
2080 (string-prefix? "mips" system)))
2081 #:make-flags
2082 (list (string-append "PREFIX=" (assoc-ref %outputs "out"))
2083 "SHELL=bash"
2084 "NO_LAPACK=1"
2085 ;; Build the library for all supported CPUs. This allows
2086 ;; switching CPU targets at runtime with the environment variable
2087 ;; OPENBLAS_CORETYPE=<type>, where "type" is a supported CPU type.
2088 ;; Unfortunately, this is not supported on non-x86 architectures,
2089 ;; where it leads to failed builds.
2090 ,@(let ((system (or (%current-target-system) (%current-system))))
2091 (cond
2092 ((or (string-prefix? "x86_64" system)
2093 (string-prefix? "i686" system))
2094 '("DYNAMIC_ARCH=1"))
2095 ;; On MIPS we force the "SICORTEX" TARGET, as for the other
2096 ;; two available MIPS targets special extended instructions
2097 ;; for Loongson cores are used.
2098 ((string-prefix? "mips" system)
2099 '("TARGET=SICORTEX"))
2100 (else '()))))
2101 ;; no configure script
2102 #:phases (alist-delete 'configure %standard-phases)))
2103 (inputs
2104 `(("fortran" ,gfortran)))
2105 (native-inputs
2106 `(("cunit" ,cunit)
2107 ("perl" ,perl)))
2108 (home-page "http://www.openblas.net/")
2109 (synopsis "Optimized BLAS library based on GotoBLAS")
2110 (description
2111 "OpenBLAS is a BLAS library forked from the GotoBLAS2-1.13 BSD version.")
2112 (license license:bsd-3)))
2113
2114 (define-public openlibm
2115 (package
2116 (name "openlibm")
2117 (version "0.5.1")
2118 (source
2119 (origin
2120 (method url-fetch)
2121 (uri (string-append "https://github.com/JuliaLang/openlibm/archive/v"
2122 version ".tar.gz"))
2123 (file-name (string-append name "-" version ".tar.gz"))
2124 (sha256
2125 (base32
2126 "11czx2z7nh6dfpz45s3xl7v38hw36jxzxfvny454bk3if14pfakq"))))
2127 (build-system gnu-build-system)
2128 (arguments
2129 `(#:make-flags
2130 (list (string-append "prefix=" (assoc-ref %outputs "out")))
2131 #:phases
2132 ;; no configure script
2133 (alist-delete 'configure %standard-phases)
2134 #:tests? #f)) ;the tests are part of the default target
2135 (home-page "http://openlibm.org/")
2136 (synopsis "Portable C mathematical library (libm)")
2137 (description
2138 "OpenLibm is an effort to have a high quality, portable, standalone C
2139 mathematical library (libm). It can be used standalone in applications and
2140 programming language implementations. The project was born out of a need to
2141 have a good libm for the Julia programming language that worked consistently
2142 across compilers and operating systems, and in 32-bit and 64-bit
2143 environments.")
2144 ;; Each architecture has its own make target, and there is none for mips.
2145 (supported-systems (delete "mips64el-linux" %supported-systems))
2146 ;; See LICENSE.md for details.
2147 (license (list license:expat
2148 license:isc
2149 license:bsd-2
2150 license:public-domain
2151 license:lgpl2.1+))))
2152
2153 (define-public openspecfun
2154 (package
2155 (name "openspecfun")
2156 (version "0.5.2")
2157 (source
2158 (origin
2159 (method url-fetch)
2160 (uri (string-append "https://github.com/JuliaLang/openspecfun/archive/v"
2161 version ".tar.gz"))
2162 (file-name (string-append name "-" version ".tar.gz"))
2163 (sha256
2164 (base32
2165 "1y5b2h6f2k72536kym3vzy3li3bhpd23x463g7hdmjdi3cncavz1"))))
2166 (build-system gnu-build-system)
2167 (arguments
2168 '(#:tests? #f ;no "check" target
2169 #:make-flags
2170 (list (string-append "prefix=" (assoc-ref %outputs "out")))
2171 ;; no configure script
2172 #:phases (alist-delete 'configure %standard-phases)))
2173 (inputs
2174 `(("fortran" ,gfortran)))
2175 (home-page "https://github.com/JuliaLang/openspecfun")
2176 (synopsis "Collection of special mathematical functions")
2177 (description
2178 "Openspecfun provides AMOS and Faddeeva. AMOS (from Netlib) is a
2179 portable package for Bessel Functions of a Complex Argument and Nonnegative
2180 Order; it contains subroutines for computing Bessel functions and Airy
2181 functions. Faddeeva allows computing the various error functions of arbitrary
2182 complex arguments (Faddeeva function, error function, complementary error
2183 function, scaled complementary error function, imaginary error function, and
2184 Dawson function); given these, one can also easily compute Voigt functions,
2185 Fresnel integrals, and similar related functions as well.")
2186 ;; Faddeeva is released under the Expat license; AMOS is included as
2187 ;; public domain software.
2188 (license (list license:expat license:public-domain))))
2189
2190 (define-public suitesparse
2191 (package
2192 (name "suitesparse")
2193 (version "4.4.3")
2194 (source
2195 (origin
2196 (method url-fetch)
2197 (uri (string-append
2198 "http://faculty.cse.tamu.edu/davis/SuiteSparse/SuiteSparse-"
2199 version ".tar.gz"))
2200 (sha256
2201 (base32
2202 "100hdzr0mf4mzlwnqpmwpfw4pymgsf9n3g0ywb1yps2nk1zbkdy5"))))
2203 (build-system gnu-build-system)
2204 (arguments
2205 '(#:parallel-build? #f ;cholmod build fails otherwise
2206 #:tests? #f ;no "check" target
2207 #:make-flags
2208 (list "CC=gcc"
2209 "BLAS=-lblas"
2210 "TBB=-ltbb"
2211 "CHOLMOD_CONFIG=-DNPARTITION" ;required when METIS is not used
2212 (string-append "INSTALL_LIB="
2213 (assoc-ref %outputs "out") "/lib")
2214 (string-append "INSTALL_INCLUDE="
2215 (assoc-ref %outputs "out") "/include"))
2216 #:phases
2217 (alist-cons-before
2218 'install 'prepare-out
2219 ;; README.txt states that the target directories must exist prior to
2220 ;; running "make install".
2221 (lambda _
2222 (mkdir-p (string-append (assoc-ref %outputs "out") "/lib"))
2223 (mkdir-p (string-append (assoc-ref %outputs "out") "/include")))
2224 ;; no configure script
2225 (alist-delete 'configure %standard-phases))))
2226 (inputs
2227 `(("tbb" ,tbb)
2228 ("lapack" ,lapack)))
2229 (home-page "http://faculty.cse.tamu.edu/davis/suitesparse.html")
2230 (synopsis "Suite of sparse matrix software")
2231 (description
2232 "SuiteSparse is a suite of sparse matrix algorithms, including: UMFPACK,
2233 multifrontal LU factorization; CHOLMOD, supernodal Cholesky; SPQR,
2234 multifrontal QR; KLU and BTF, sparse LU factorization, well-suited for circuit
2235 simulation; ordering methods (AMD, CAMD, COLAMD, and CCOLAMD); CSparse and
2236 CXSparse, a concise sparse Cholesky factorization package; and many other
2237 packages.")
2238 ;; LGPLv2.1+:
2239 ;; AMD, CAMD, BTF, COLAMD, CCOLAMD, CSparse, CXSparse, KLU, LDL
2240 ;; GPLv2+:
2241 ;; GPUQREngine, RBio, SuiteSparse_GPURuntime, SuiteSparseQR, UMFPACK
2242 (license (list license:gpl2+ license:lgpl2.1+))))
2243
2244 (define-public atlas
2245 (package
2246 (name "atlas")
2247 (version "3.10.3")
2248 (source (origin
2249 (method url-fetch)
2250 (uri (string-append "mirror://sourceforge/math-atlas/Stable/"
2251 version "/atlas" version ".tar.bz2"))
2252 (sha256
2253 (base32
2254 "1dyjlq3fiparvm8ypwk6rsmjzmnwk81l88gkishphpvc79ryp216"))))
2255 (build-system gnu-build-system)
2256 (home-page "http://math-atlas.sourceforge.net/")
2257 (inputs `(("gfortran" ,gfortran)
2258 ("lapack-tar" ,(package-source lapack))))
2259 (outputs '("out" "doc"))
2260 ;; For the moment we drop support for MIPS at it fails to compile. See
2261 ;; https://lists.gnu.org/archive/html/guix-devel/2014-11/msg00516.html
2262 (supported-systems (delete "mips64el-linux" %supported-systems))
2263 (arguments
2264 `(#:parallel-build? #f
2265 #:parallel-tests? #f
2266
2267 ;; ATLAS tunes itself for the machine it is built on, as explained at
2268 ;; <http://lists.gnu.org/archive/html/guix-devel/2014-10/msg00305.html>.
2269 ;; For this reason, we want users to build it locally instead of using
2270 ;; substitutes.
2271 #:substitutable? #f
2272
2273 #:modules ((srfi srfi-26)
2274 (srfi srfi-1)
2275 (guix build gnu-build-system)
2276 (guix build utils))
2277 #:configure-flags
2278 `(;; Generate position independent code suitable for dynamic libraries
2279 ;; and use WALL timer to get more accurate timing.
2280 "-Fa" "alg" "-fPIC" "-D" "c" "-DWALL"
2281 ;; Set word width.
2282 "-b"
2283 ,,(if (string-match "64" (%current-system))
2284 "64"
2285 "32")
2286 ;; Disable parallel build as it gives errors: atlas_pthread.h is
2287 ;; needed to compile C files before it is generated.
2288 "-Ss" "pmake" "make -j 1"
2289 ;; Probe is failing for MIPS. We therefore define the system
2290 ;; architecture explicitly by setting (-A) MACHINETYPE = 49
2291 ;; 'MIPSR1xK' and (-V) ISA = 1 'none'.
2292 ,,@(if (string-prefix? "mips" (%current-system))
2293 (list "-A" "49" "-V" "1")
2294 (list))
2295 ;; Generate shared libraries.
2296 "--shared"
2297 ;; Build a full LAPACK library.
2298 ,(string-append "--with-netlib-lapack-tarfile="
2299 (assoc-ref %build-inputs "lapack-tar")))
2300 #:phases
2301 (modify-phases %standard-phases
2302 (add-after 'install 'install-doc
2303 (lambda* (#:key outputs inputs #:allow-other-keys)
2304 (let ((doc (string-append (assoc-ref outputs "doc")
2305 "/share/doc/atlas")))
2306 (mkdir-p doc)
2307 (fold (lambda (file previous)
2308 (and previous (zero? (system* "cp" file doc))))
2309 #t (find-files "../ATLAS/doc" ".*")))))
2310 (add-after 'check 'check-pt
2311 (lambda _ (zero? (system* "make" "ptcheck"))))
2312 ;; Fix files required to run configure.
2313 (add-before 'configure 'fix-/bin/sh
2314 (lambda _
2315 ;; Use `sh', not `/bin/sh'.
2316 (substitute* (find-files "." "Makefile|configure|SpewMakeInc\\.c")
2317 (("/bin/sh")
2318 "sh"))))
2319 ;; Fix /bin/sh in generated make files.
2320 (add-after 'configure 'fix-/bin/sh-in-generated-files
2321 (lambda _
2322 (substitute* (find-files "." "^[Mm]ake\\.inc.*")
2323 (("/bin/sh")
2324 "sh"))))
2325 ;; ATLAS configure program does not accepts the default flags
2326 ;; passed by the 'gnu-build-system'.
2327 (replace 'configure
2328 (lambda* (#:key native-inputs inputs outputs
2329 (configure-flags '())
2330 #:allow-other-keys #:rest args)
2331 (let* ((prefix (assoc-ref outputs "out"))
2332 (bash (or (and=> (assoc-ref
2333 (or native-inputs inputs) "bash")
2334 (cut string-append <> "/bin/bash"))
2335 "/bin/sh"))
2336 (flags `(,(string-append "--prefix=" prefix)
2337 ,@configure-flags))
2338 (abs-srcdir (getcwd))
2339 (srcdir (string-append "../" (basename abs-srcdir))))
2340 (format #t "source directory: ~s (relative from build: ~s)~%"
2341 abs-srcdir srcdir)
2342 (mkdir "../build")
2343 (chdir "../build")
2344 (format #t "build directory: ~s~%" (getcwd))
2345 (format #t "configure flags: ~s~%" flags)
2346 (zero? (apply system* bash
2347 (string-append srcdir "/configure")
2348 flags))))))))
2349 (synopsis "Automatically Tuned Linear Algebra Software")
2350 (description
2351 "ATLAS is an automatically tuned linear algebra software library
2352 providing C and Fortran77 interfaces to a portably efficient BLAS
2353 implementation, as well as a few routines from LAPACK.
2354
2355 Optimization occurs at build time. For this reason, the library is built on
2356 the machine where it is installed, without resorting to pre-built substitutes.
2357
2358 Before building the library, CPU throttling should be disabled. This can be
2359 done in the BIOS, or, on GNU/Linux, with the following command:
2360
2361 @example
2362 # cpupower --governor performance
2363 @end example
2364
2365 Failure to do so will result in a library with poor performance.")
2366 (license license:bsd-3)))
2367
2368 (define-public glm
2369 (package
2370 (name "glm")
2371 (version "0.9.6.3")
2372 (source
2373 (origin
2374 (method url-fetch)
2375 (uri (string-append "mirror://sourceforge/ogl-math/glm-" version
2376 "/glm-" version ".zip"))
2377 (sha256
2378 (base32
2379 "1cnjmi033a16a95v6xfkr1bvfmkd26hzdjka8j1819hgn5b1nr8l"))))
2380 (build-system cmake-build-system)
2381 (native-inputs
2382 `(("unzip" ,unzip)))
2383 (home-page "http://glm.g-truc.net")
2384 (synopsis "OpenGL Mathematics library")
2385 (description "OpenGL Mathematics (GLM) is a header-only C++ mathematics
2386 library for graphics software based on the OpenGL Shading Language (GLSL)
2387 specifications.")
2388 (license license:expat)))
2389
2390 (define-public lpsolve
2391 (package
2392 (name "lpsolve")
2393 (version "5.5.2.0")
2394 (source
2395 (origin
2396 (method url-fetch)
2397 (uri (string-append "mirror://sourceforge/lpsolve/lpsolve/" version
2398 "/lp_solve_" version "_source.tar.gz"))
2399 (sha256
2400 (base32
2401 "176c7f023mb6b8bfmv4rfqnrlw88lsg422ca74zjh19i2h5s69sq"))
2402 (modules '((guix build utils)))
2403 (snippet
2404 '(substitute* (list "lp_solve/ccc" "lpsolve55/ccc")
2405 (("^c=cc") "c=gcc")
2406 ;; Pretend to be on a 64 bit platform to obtain a common directory
2407 ;; name for the build results on all architectures; nothing else
2408 ;; seems to depend on it.
2409 (("^PLATFORM=.*$") "PLATFORM=ux64\n")
2410
2411 ;; The check for 'isnan' as it is written fails with
2412 ;; "non-floating-point argument in call to function
2413 ;; ‘__builtin_isnan’", which leads to the 'NOISNAN' cpp macro
2414 ;; definition, which in turn leads to bad things. Fix the feature
2415 ;; test.
2416 (("isnan\\(0\\)") "isnan(0.)")))))
2417 (build-system gnu-build-system)
2418 (arguments
2419 `(#:tests? #f ; no check target
2420 #:phases
2421 (modify-phases %standard-phases
2422 (delete 'configure)
2423 (replace 'build
2424 (lambda _
2425 (and (with-directory-excursion "lpsolve55"
2426 (zero? (system* "bash" "ccc")))
2427 (with-directory-excursion "lp_solve"
2428 (zero? (system* "bash" "ccc"))))))
2429 (replace 'install
2430 (lambda* (#:key outputs #:allow-other-keys)
2431 (let* ((out (assoc-ref outputs "out"))
2432 (bin (string-append out "/bin"))
2433 (lib (string-append out "/lib"))
2434 ;; This is where LibreOffice expects to find the header
2435 ;; files, and where they are installed by Debian.
2436 (include (string-append out "/include/lpsolve")))
2437 (mkdir-p lib)
2438 (copy-file "lpsolve55/bin/ux64/liblpsolve55.a"
2439 (string-append lib "/liblpsolve55.a"))
2440 (copy-file "lpsolve55/bin/ux64/liblpsolve55.so"
2441 (string-append lib "/liblpsolve55.so"))
2442 (install-file "lp_solve/bin/ux64/lp_solve" bin)
2443
2444 ;; Install a subset of the header files as on Debian
2445 ;; (plus lp_bit.h, which matches the regular expression).
2446 (for-each (lambda (name)
2447 (install-file name include))
2448 (find-files "." "lp_[HMSa-z].*\\.h$"))
2449 (with-directory-excursion "shared"
2450 (for-each (lambda (name)
2451 (install-file name include))
2452 (find-files "." "\\.h$")))
2453 #t))))))
2454 (home-page "http://lpsolve.sourceforge.net/")
2455 (synopsis "Mixed integer linear programming (MILP) solver")
2456 (description
2457 "lp_solve is a mixed integer linear programming solver based on the
2458 revised simplex and the branch-and-bound methods.")
2459 (license license:lgpl2.1+)))
2460
2461 (define-public dealii
2462 (package
2463 (name "dealii")
2464 (version "8.4.1")
2465 (source
2466 (origin
2467 (method url-fetch)
2468 (uri (string-append "https://github.com/dealii/dealii/releases/"
2469 "download/v" version "/dealii-" version ".tar.gz"))
2470 (sha256
2471 (base32
2472 "1bdksvvyp1rj37df1ndh8j3x9nzpc3sazw8nd0hzvnlw0qnyk800"))
2473 (modules '((guix build utils)))
2474 (snippet
2475 ;; Remove bundled sources: UMFPACK, TBB, muParser, and boost
2476 '(delete-file-recursively "bundled"))))
2477 (build-system cmake-build-system)
2478 (inputs
2479 `(("tbb" ,tbb)
2480 ("zlib" ,zlib)
2481 ("boost" ,boost)
2482 ("p4est" ,p4est)
2483 ("blas" ,openblas)
2484 ("lapack" ,lapack)
2485 ("arpack" ,arpack-ng)
2486 ("muparser" ,muparser)
2487 ("gfortran" ,gfortran)
2488 ("suitesparse" ,suitesparse))) ;for UMFPACK
2489 (arguments
2490 `(#:build-type "DebugRelease" ;only supports Release, Debug, or DebugRelease
2491 #:configure-flags '("-DCOMPAT_FILES=OFF") ;Follow new directory structure
2492 #:phases (modify-phases %standard-phases
2493 (add-after
2494 'install 'hint-example-prefix
2495 ;; Set Cmake hints in examples so that they can find this
2496 ;; deal.II when configuring.
2497 (lambda* (#:key outputs #:allow-other-keys)
2498 (let* ((out (assoc-ref %outputs "out"))
2499 (exmpl (string-append out "/share/doc"
2500 "/dealii/examples")))
2501 (substitute* (find-files exmpl "CMakeLists.txt")
2502 (("([[:space:]]*HINTS.*)\n" _ line)
2503 (string-append line " $ENV{HOME}/.guix-profile "
2504 out "\n")))
2505 #t))))))
2506 (home-page "https://www.dealii.org")
2507 (synopsis "Finite element library")
2508 (description
2509 "Deal.II is a C++ program library targeted at the computational solution
2510 of partial differential equations using adaptive finite elements. The main
2511 aim of deal.II is to enable rapid development of modern finite element codes,
2512 using among other aspects adaptive meshes and a wide array of tools often used
2513 in finite element programs.")
2514 (license license:lgpl2.1+)))
2515
2516 (define-public dealii-openmpi
2517 (package (inherit dealii)
2518 (name "dealii-openmpi")
2519 (inputs
2520 `(("mpi" ,openmpi)
2521 ;;Supported only with MPI:
2522 ("p4est" ,p4est-openmpi)
2523 ("petsc" ,petsc-openmpi)
2524 ("slepc" ,slepc-openmpi)
2525 ("metis" ,metis) ;for MUMPS
2526 ("scalapack" ,scalapack) ;for MUMPS
2527 ("mumps" ,mumps-metis-openmpi) ;configure supports only metis orderings
2528 ("arpack" ,arpack-ng-openmpi)
2529 ,@(fold alist-delete (package-inputs dealii)
2530 '("p4est" "arpack"))))
2531 (arguments
2532 (substitute-keyword-arguments (package-arguments dealii)
2533 ((#:configure-flags cf)
2534 ``("-DMPI_C_COMPILER=mpicc"
2535 "-DMPI_CXX_COMPILER=mpicxx"
2536 "-DMPI_Fortran_COMPILER=mpifort"
2537 ,@,cf))))
2538 (synopsis "Finite element library (with MPI support)")))
2539
2540 (define-public flann
2541 (package
2542 (name "flann")
2543 (version "1.8.4")
2544 (source
2545 (origin
2546 (method url-fetch)
2547 (uri
2548 (string-append
2549 "http://www.cs.ubc.ca/research/flann/uploads/FLANN/flann-"
2550 version "-src.zip"))
2551 (sha256
2552 (base32
2553 "022w8hph7bli5zbpnk3z1qh1c2sl5hm8fw2ccim651ynn0hr7fyz"))))
2554 (build-system cmake-build-system)
2555 (native-inputs
2556 `(("unzip" ,unzip)))
2557 (inputs
2558 `(("hdf5" ,hdf5)
2559 ("octave" ,octave)
2560 ("python" ,python-2) ; print syntax
2561 ;; ("python2-numpy" ,python2-numpy) ; only required for the tests
2562 ("zlib" ,zlib)))
2563 (arguments
2564 `(;; The 'share/flann/octave' contains a .mex file, which is an ELF file
2565 ;; taken 46 MiB unstripped, and 6 MiB stripped.
2566 #:strip-directories '("lib" "lib64" "libexec"
2567 "bin" "sbin" "share/flann/octave")
2568
2569 ;; Save 12 MiB by not installing .a files. Passing
2570 ;; '-DBUILD_STATIC_LIBS=OFF' has no effect.
2571 #:phases (modify-phases %standard-phases
2572 (add-after 'install 'remove-static-libraries
2573 (lambda* (#:key outputs #:allow-other-keys)
2574 (let* ((out (assoc-ref outputs "out"))
2575 (lib (string-append out "/lib")))
2576 (for-each delete-file
2577 (find-files lib "\\.a$"))
2578 #t))))
2579
2580 #:tests? #f)) ; The test data are downloaded from the Internet.
2581 (home-page "http://www.cs.ubc.ca/research/flann/")
2582 (synopsis "Library for approximate nearest neighbors computation")
2583 (description "FLANN is a library for performing fast approximate
2584 nearest neighbor searches in high dimensional spaces. It implements a
2585 collection of algorithms and a system for automatically choosing the best
2586 algorithm and optimum parameters depending on the dataset.
2587
2588 FLANN is written in C++ and contains bindings for C, Octave and Python.")
2589 (license (license:non-copyleft "file://COPYING"
2590 "See COPYING in the distribution."))))
2591
2592 (define-public wcalc
2593 (package
2594 (name "wcalc")
2595 (version "2.5")
2596 (source
2597 (origin
2598 (method url-fetch)
2599 (uri (string-append "mirror://sourceforge/w-calc/Wcalc/" version "/"
2600 "wcalc-" version ".tar.bz2"))
2601 (sha256
2602 (base32
2603 "1vi8dl6rccqiq1apmpwawyg2ywx6a1ic1d3cvkf2hlwk1z11fb0f"))))
2604 (build-system gnu-build-system)
2605 (inputs
2606 `(("mpfr" ,mpfr)
2607 ("readline" ,readline)))
2608 (home-page "http://w-calc.sourceforge.net/index.php")
2609 (synopsis "Flexible command-line scientific calculator")
2610 (description "Wcalc is a very capable calculator. It has standard functions
2611 (sin, asin, and sinh for example, in either radians or degrees), many
2612 pre-defined constants (pi, e, c, etc.), support for using variables, \"active\"
2613 variables, a command history, hex/octal/binary input and output, unit
2614 conversions, embedded comments, and an expandable expression entry field. It
2615 evaluates expressions using the standard order of operations.")
2616 (license license:gpl2+)))
2617
2618 (define-public xaos
2619 (package
2620 (name "xaos")
2621 (version "3.6")
2622 (source (origin
2623 (method url-fetch)
2624 (uri (string-append "mirror://sourceforge/xaos/XaoS/" version
2625 "/xaos-" version ".tar.gz"))
2626 (sha256
2627 (base32
2628 "15cd1cx1dyygw6g2nhjqq3bsfdj8sj8m4va9n75i0f3ryww3x7wq"))))
2629 (build-system gnu-build-system)
2630 (native-inputs `(("gettext" ,gnu-gettext)))
2631 (inputs `(("libx11" ,libx11)
2632 ("zlib" ,zlib)
2633 ("libpng" ,libpng)
2634 ("gsl" ,gsl)))
2635 (arguments
2636 `(#:tests? #f ;no "check" target
2637 #:make-flags '("LOCALEDIR=$DATAROOTDIR/locale")))
2638 (synopsis "Real-time fractal zoomer")
2639 (description "GNU XaoS is a graphical program that generates fractal
2640 patterns and allows you to zoom in and out of them infinitely in a fluid,
2641 continuous manner. It also includes tutorials that help to explain how fractals
2642 are built. It can generate many different fractal types such as the Mandelbrot
2643 set.")
2644 (home-page "http://www.gnu.org/software/xaos/")
2645 (license license:gpl2+)))
2646
2647 (define-public hypre
2648 (package
2649 (name "hypre")
2650 (version "2.11.0")
2651 (source (origin
2652 (method url-fetch)
2653 (uri (string-append "https://github.com/LLNL/hypre/archive/"
2654 "v" version ".tar.gz"))
2655 (file-name (string-append name "-" version ".tar.gz"))
2656 (sha256
2657 (base32
2658 "0q69ia0jivzcr8p049dn3mg8yjpn6nwq4sw9iqac8vr63vi54l6m"))
2659 (modules '((guix build utils)))
2660 (snippet
2661 '(begin
2662 ;; Remove use of __DATE__ and __TIME__ for reproducibility;
2663 ;; substitute the tarball creation time.
2664 (substitute* "src/utilities/HYPRE_utilities.h"
2665 (("Date Compiled: .*$")
2666 "Date Compiled: Mar 28 2016 20:19:59 +0000\"\n"))
2667 #t))))
2668 (build-system gnu-build-system)
2669 (outputs '("out" ;6.1 MiB of headers and libraries
2670 "doc")) ;4.8 MiB of documentation
2671 (native-inputs
2672 `(("doc++" ,doc++)
2673 ("netpbm" ,netpbm)
2674 ("texlive" ,texlive) ;full package required for fonts
2675 ("ghostscript" ,ghostscript)))
2676 (inputs
2677 `(("blas" ,openblas)
2678 ("lapack" ,lapack)))
2679 (arguments
2680 `(#:modules ((srfi srfi-1)
2681 ,@%gnu-build-system-modules)
2682 #:configure-flags '("--enable-shared"
2683 "--disable-fortran"
2684 "--without-MPI"
2685 "--with-openmp"
2686 "--with-fei"
2687 "--with-lapack"
2688 "--with-blas")
2689 #:phases
2690 (modify-phases %standard-phases
2691 (add-before 'configure 'chdir-src
2692 (lambda _ (chdir "src")))
2693 (replace 'configure
2694 (lambda* (#:key build target configure-flags
2695 #:allow-other-keys #:rest args)
2696 (let* ((configure (assoc-ref %standard-phases 'configure)))
2697 (apply configure
2698 (append args
2699 (list #:configure-flags
2700 (cons (string-append
2701 "--host=" (or target build))
2702 configure-flags)))))))
2703 (add-after 'build 'build-docs
2704 (lambda _
2705 (zero? (system* "make" "-Cdocs" "pdf" "html"))))
2706 (replace 'check
2707 (lambda _
2708 (setenv "LD_LIBRARY_PATH" (string-append (getcwd) "/hypre/lib"))
2709 (setenv "PATH" (string-append "." ":" (getenv "PATH")))
2710 (and (system* "make" "check" "CHECKRUN=")
2711 (fold (lambda (filename result)
2712 (and result
2713 (let ((size (stat:size (stat filename))))
2714 (when (not (zero? size))
2715 (format #t "~a size ~d; error indication~%"
2716 filename size))
2717 (zero? size))))
2718 #t
2719 (find-files "test" ".*\\.err$")))))
2720 (add-after 'install 'install-docs
2721 (lambda* (#:key outputs #:allow-other-keys)
2722 ;; Custom install because docs/Makefile doesn't honor ${docdir}.
2723 (let* ((doc (assoc-ref outputs "doc"))
2724 (docdir (string-append doc "/share/doc/hypre-" ,version)))
2725 (mkdir-p docdir)
2726 (with-directory-excursion "docs"
2727 (for-each (lambda (base)
2728 (install-file (string-append base ".pdf") docdir)
2729 (copy-recursively base docdir)) ;html docs
2730 '("HYPRE_usr_manual"
2731 "HYPRE_ref_manual")))
2732 #t))))))
2733 (home-page "http://www.llnl.gov/casc/hypre/")
2734 (synopsis "Library of solvers and preconditioners for linear equations")
2735 (description
2736 "HYPRE is a software library of high performance preconditioners and
2737 solvers for the solution of large, sparse linear systems of equations. It
2738 features multigrid solvers for both structured and unstructured grid
2739 problems.")
2740 (license license:lgpl2.1)))
2741
2742 (define-public hypre-openmpi
2743 (package (inherit hypre)
2744 (name "hypre-openmpi")
2745 (inputs
2746 `(("mpi" ,openmpi)
2747 ,@(package-inputs hypre)))
2748 (arguments
2749 (substitute-keyword-arguments (package-arguments hypre)
2750 ((#:configure-flags flags)
2751 ``("--with-MPI"
2752 ,@(delete "--without-MPI" ,flags)))))
2753 (synopsis "Parallel solvers and preconditioners for linear equations")
2754 (description
2755 "HYPRE is a software library of high performance preconditioners and
2756 solvers for the solution of large, sparse linear systems of equations on
2757 parallel computers. It features parallel multigrid solvers for both
2758 structured and unstructured grid problems.")))
2759
2760 (define-public matio
2761 (package
2762 (name "matio")
2763 (version "1.5.6")
2764 (source
2765 (origin
2766 (method url-fetch)
2767 (uri (string-append "mirror://sourceforge/matio/matio/" version "/"
2768 "matio-" version ".tar.gz"))
2769 (sha256
2770 (base32
2771 "0y2qymgxank8wdiwc68ap8bxdzrhvyw86i29yh3xgn4z1njfd9ir"))))
2772 (build-system gnu-build-system)
2773 (inputs
2774 `(("zlib" ,zlib)
2775 ("hdf5" ,hdf5)))
2776 (home-page "http://matio.sourceforge.net/")
2777 (synopsis "Library for reading and writing MAT files")
2778 (description "Matio is a library for reading and writing MAT files. It
2779 supports compressed MAT files, as well as newer (version 7.3) MAT files.")
2780 (license license:bsd-2)))
2781
2782 (define-public libhilbert
2783 (package
2784 (name "libhilbert")
2785 (version "0.2-1")
2786 (source
2787 (origin
2788 (method url-fetch)
2789 (uri (string-append "http://web.cs.dal.ca/~chamilto/hilbert/"
2790 "libhilbert-" version ".tar.gz"))
2791 (sha256
2792 (base32
2793 "0v48x8405dj95gjn2saja4bzhw86d6zl6d3dg8h7dzac2qr97s34"))))
2794 (build-system gnu-build-system)
2795 (home-page "http://web.cs.dal.ca/~chamilto/hilbert")
2796 (synopsis "Hilbert indices for multidimensional data")
2797 (description "The libhilbert library can efficiently calculate Hilbert
2798 curves and order-preserving representations of Hilbert curve indices that use
2799 the same amount of space as the original point representation. This is useful
2800 when using the Gilbert curve as a space filling curve through a
2801 high-dimensional space where not all demensions have the same cardinality.")
2802 (license license:lgpl2.1+)))
2803
2804 (define-public vc
2805 (package
2806 (name "vc")
2807 (version "1.2.0")
2808 (source
2809 (origin (method url-fetch)
2810 (uri (string-append "https://github.com/VcDevel/Vc/releases/"
2811 "download/" version "/Vc-" version ".tar.gz"))
2812 (sha256
2813 (base32
2814 "1rh6dhqar3y07n4xqyml0sa0v48qv3ch9dc3yc2in855hlh4vnqi"))))
2815 (build-system cmake-build-system)
2816 (arguments
2817 '(#:configure-flags
2818 '("-DBUILD_TESTING=ON")))
2819 (synopsis "SIMD vector classes for C++")
2820 (description "Vc provides portable, zero-overhead C++ types for explicitly
2821 data-parallel programming. It is a library designed to ease explicit
2822 vectorization of C++ code. Its types enable explicitly stating data-parallel
2823 operations on multiple values. The parallelism is therefore added via the type
2824 system. Vc has an intuitive API and provides portability between different
2825 compilers and compiler versions as well as portability between different vector
2826 instruction sets. Thus, an application written with Vc can be compiled for:
2827 @enumerate
2828 @item AVX and AVX2
2829 @item SSE2 upto SSE4.2 or SSE4a
2830 @item Scalar
2831 @item MIC
2832 @item NEON (in development)
2833 @item NVIDIA GPUs / CUDA (in development)
2834 @end enumerate\n")
2835 (home-page "https://github.com/VcDevel/Vc")
2836 (license license:bsd-3)))