2 # This file is part of the GROMACS molecular simulation package.
4 # Copyright (c) 2015,2016,2017,2018, by the GROMACS development team, led by
5 # Mark Abraham, David van der Spoel, Berk Hess, and Erik Lindahl,
6 # and including many others, as listed in the AUTHORS file in the
7 # top-level source directory and at http://www.gromacs.org.
9 # GROMACS is free software; you can redistribute it and/or
10 # modify it under the terms of the GNU Lesser General Public License
11 # as published by the Free Software Foundation; either version 2.1
12 # of the License, or (at your option) any later version.
14 # GROMACS is distributed in the hope that it will be useful,
15 # but WITHOUT ANY WARRANTY; without even the implied warranty of
16 # MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the GNU
17 # Lesser General Public License for more details.
19 # You should have received a copy of the GNU Lesser General Public
20 # License along with GROMACS; if not, see
21 # http://www.gnu.org/licenses, or write to the Free Software Foundation,
22 # Inc., 51 Franklin Street, Fifth Floor, Boston, MA 02110-1301 USA.
24 # If you want to redistribute modifications to GROMACS, please
25 # consider that scientific software is very special. Version
26 # control is crucial - bugs must be traceable. We will be happy to
27 # consider code for inclusion in the official distribution, but
28 # derived work must not be called official GROMACS. Details are found
29 # in the README & COPYING files - if they are missing, get the
30 # official version at http://www.gromacs.org.
32 # To help us fund GROMACS development, we humbly ask that you cite
33 # the research papers on the package. Check out http://www.gromacs.org.
35 # -*- coding: utf-8 -*-
37 # GROMACS documentation build configuration file, created by
38 # sphinx-quickstart on Tue Jan 13 14:28:44 2015.
40 # This file is execfile()d with the current directory set to its
43 # Note that not all possible configuration values are present in this
46 # All configuration values have a default; values that are commented out
47 # serve to show the default.
53 execfile('conf-vars.py')
54 sys
.path
.append(gmx_sphinx_extension_path
)
55 if releng_path
and os
.path
.isdir(releng_path
):
56 sys
.path
.append(releng_path
)
58 # If extensions (or modules to document with autodoc) are in another directory,
59 # add these directories to sys.path here. If the directory is relative to the
60 # documentation root, use os.path.abspath to make it absolute, like shown here.
61 #sys.path.insert(0, os.path.abspath('.'))
63 # -- General configuration ------------------------------------------------
65 # If your documentation needs a minimal Sphinx version, state it here.
66 # gmx_min_sphinx is set from the expected minimum version of Sphinx
68 needs_sphinx
= gmx_min_sphinx
70 # Add any Sphinx extension module names here, as strings. They can be
71 # extensions coming with Sphinx (named 'sphinx.ext.*') or your custom
75 'sphinx.ext.graphviz',
76 'sphinx.ext.extlinks',
77 'sphinx.ext.napoleon',
79 'sphinx.ext.ifconfig',
82 extlinks
= {'issue': ('https://redmine.gromacs.org/issues/%s',
85 # Add any paths that contain templates here, relative to this directory.
86 # templates_path = ['_templates']
88 # The suffix of source filenames.
89 source_suffix
= '.rst'
91 # The encoding of source files.
92 #source_encoding = 'utf-8-sig'
94 # The master toctree document.
97 # General information about the project.
99 copyright
= str(datetime
.datetime
.now().year
) + u
', GROMACS development team'
101 # The version info for the project you're documenting, acts as replacement for
102 # |version| and |release|, also used in various other places throughout the
105 # The short X.Y version.
106 version
= gmx_version_string
107 # The full version, including alpha/beta/rc tags.
108 release
= gmx_version_string_full
110 # The language for content autogenerated by Sphinx. Refer to documentation
111 # for a list of supported languages.
114 # There are two options for replacing |today|: either, you set today to some
115 # non-false value, then it is used:
117 # Else, today_fmt is used as the format for a strftime call.
118 #today_fmt = '%B %d, %Y'
120 # List of patterns, relative to source directory, that match files and
121 # directories to ignore when looking for source files.
122 exclude_patterns
= ['fragments']
123 if not tags
.has('do_man'):
124 exclude_patterns
+= ['man']
126 # The reST default role (used for this markup: `text`) to use for all
130 # If true, '()' will be appended to :func: etc. cross-reference text.
131 #add_function_parentheses = True
133 # If true, the current module name will be prepended to all description
134 # unit titles (such as .. function::).
135 #add_module_names = True
137 # If true, sectionauthor and moduleauthor directives will be shown in the
138 # output. They are ignored by default.
139 #show_authors = False
141 # The name of the Pygments (syntax highlighting) style to use.
142 pygments_style
= 'sphinx'
144 # A list of ignored prefixes for module index sorting.
145 #modindex_common_prefix = []
147 # If true, keep warnings as "system message" paragraphs in the built documents.
148 #keep_warnings = False
150 # Configure the values for all the variables that might later configure any of the .rst files.
151 substitutions
= ['.. |{0}| replace:: {1}'.format(*x
) for x
in variables
if x
[1]]
152 substitutions
.extend(['.. |{0}| replace:: unknown'.format(x
[0]) for x
in variables
if x
[1] == ''])
153 rst_epilog
= "\n".join(substitutions
)
155 .. |Gromacs| replace:: GROMACS
156 .. _gmx-manual: manual-{gmx_version_string}.pdf
157 .. _gmx-manual-parent-dir: ../manual-{gmx_version_string}.pdf
158 .. |gmx-source-package-ftp| replace:: As ftp ftp://ftp.gromacs.org/pub/gromacs/gromacs-{gmx_version_string}.tar.gz
159 .. |gmx-source-package-http| replace:: As http http://ftp.gromacs.org/pub/gromacs/gromacs-{gmx_version_string}.tar.gz
160 .. |gmx-regressiontests-package| replace:: http://gerrit.gromacs.org/download/regressiontests-{regressiontest_version}.tar.gz
161 .. _up-to-date installation instructions: http://www.gromacs.org/Documentation/Installation_Instructions
162 .. _CUDA: http://www.nvidia.com/object/cuda_home_new.html
163 .. _OpenCL: https://www.khronos.org/opencl/
164 .. _OpenMPI: http://www.open-mpi.org
165 .. _MPICH: http://www.mpich.org
166 .. _LAM-MPI: http://www.lam-mpi.org
167 .. _OpenMP: http://en.wikipedia.org/wiki/OpenMP
168 .. _CMake installation page: http://www.cmake.org/install/
169 .. _Ubuntu toolchain ppa page: https://launchpad.net/~ubuntu-toolchain-r/+archive/ubuntu/test
170 .. _EPEL page: https://fedoraproject.org/wiki/EPEL
171 .. _running CMake: http://www.cmake.org/runningcmake/
172 .. _CMake environment variables: http://cmake.org/Wiki/CMake_Useful_Variables#Environment_Variables
173 .. _FFTW: http://www.fftw.org
174 .. _FFTW installation guide: http://www.fftw.org/doc/Installation-and-Customization.html#Installation-and-Customization
175 .. _MKL: https://software.intel.com/en-us/intel-mkl
176 .. _VMD: http://www.ks.uiuc.edu/Research/vmd/
177 .. _PyMOL: http://www.pymol.org
178 .. _continuous integration server used by GROMACS: http://jenkins.gromacs.org
179 .. _Jenkins: http://jenkins-ci.org
180 .. _webpage: http://www.gromacs.org
181 .. _ftp site: ftp://ftp.gromacs.org/pub/gromacs/
182 .. _tutorials: http://www.gromacs.org/Documentation/Tutorials
183 .. _download: ../download.html
184 """.format(gmx_version_string
=gmx_version_string
, regressiontest_version
=regressiontest_version
)
186 # -- Options for HTML output ----------------------------------------------
188 # The theme to use for HTML and HTML Help pages. See the documentation for
189 # a list of builtin themes.
190 html_theme
= 'classic'
192 # Theme options are theme-specific and customize the look and feel of a theme
193 # further. For a list of options available for each theme, see the
195 #html_theme_options = {}
197 # Add any paths that contain custom themes here, relative to this directory.
198 html_theme_path
= ['']
200 # The name for this set of Sphinx documents. If None, it defaults to
201 # "<project> v<release> documentation".
202 html_title
= u
'GROMACS ' + release
+ ' documentation'
204 # A shorter title for the navigation bar. Default is the same as html_title.
205 html_short_title
= u
'GROMACS ' + version
207 # The name of an image file (relative to this directory) to place at the top
211 # The name of an image file (within the static path) to use as favicon of the
212 # docs. This file should be a Windows icon file (.ico) being 16x16 or 32x32
216 # Add any paths that contain custom static files (such as style sheets) here,
217 # relative to this directory. They are copied after the builtin static files,
218 # so a file named "default.css" will overwrite the builtin "default.css".
219 html_static_path
= ['_static']
221 # Add any extra paths that contain custom files (such as robots.txt or
222 # .htaccess) here, relative to this directory. These files are copied
223 # directly to the root of the documentation.
224 #html_extra_path = []
226 # If not '', a 'Last updated on:' timestamp is inserted at every page bottom,
227 # using the given strftime format.
228 #html_last_updated_fmt = '%b %d, %Y'
230 # If true, SmartyPants will be used to convert quotes and dashes to
231 # typographically correct entities.
232 #html_use_smartypants = True
234 # Custom sidebar templates, maps document names to template names.
237 # Additional templates that should be rendered to pages, maps page names to
239 #html_additional_pages = {}
241 # If false, no module index is generated.
242 #html_domain_indices = True
244 # If false, no index is generated.
245 #html_use_index = True
247 # If true, the index is split into individual pages for each letter.
248 #html_split_index = False
250 # If true, links to the reST sources are added to the pages.
251 #html_show_sourcelink = True
253 # If true, "Created using Sphinx" is shown in the HTML footer. Default is True.
254 #html_show_sphinx = True
256 # If true, "(C) Copyright ..." is shown in the HTML footer. Default is True.
257 #html_show_copyright = True
259 # If true, an OpenSearch description file will be output, and all pages will
260 # contain a <link> tag referring to it. The value of this option must be the
261 # base URL from which the finished HTML is served.
262 #html_use_opensearch = ''
264 # This is the file name suffix for HTML files (e.g. ".xhtml").
265 #html_file_suffix = None
267 # Output file base name for HTML help builder.
268 htmlhelp_basename
= 'Gromacsdoc'
271 # -- Options for LaTeX output ---------------------------------------------
274 # The paper size ('letterpaper' or 'a4paper').
275 'papersize': 'a4paper',
277 # The font size ('10pt', '11pt' or '12pt').
280 # Additional stuff for the LaTeX preamble.
284 # Grouping the document tree into LaTeX files. List of tuples
285 # (source start file, target name, title,
286 # author, documentclass [howto, manual, or own class]).
288 ('index', 'Gromacs.tex', u
'GROMACS Documentation',
289 u
'GROMACS development team', 'manual'),
292 # The name of an image file (relative to this directory) to place at the top of
296 # For "manual" documents, if this is true, then toplevel headings are parts,
298 #latex_use_parts = False
300 # If true, show page references after internal links.
301 #latex_show_pagerefs = False
303 # If true, show URL addresses after external links.
304 #latex_show_urls = False
306 # Documents to append as an appendix to all manuals.
307 #latex_appendices = []
309 # If false, no module index is generated.
310 #latex_domain_indices = True
313 # -- Options for manual page output ---------------------------------------
315 # One entry per manual page. List of tuples
316 # (source start file, name, description, authors, manual section).
317 if tags
.has('do_man'):
318 execfile('conf-man.py')
320 # If true, show URL addresses after external links.
321 #man_show_urls = False
324 # -- Options for Texinfo output -------------------------------------------
326 # Grouping the document tree into Texinfo files. List of tuples
327 # (source start file, target name, title, author,
328 # dir menu entry, description, category)
329 texinfo_documents
= [
330 ('index', 'GROMACS', u
'GROMACS Documentation',
331 u
'GROMACS development team', 'GROMACS', 'One line description of project.',
335 # Documents to append as an appendix to all manuals.
336 #texinfo_appendices = []
338 # If false, no module index is generated.
339 #texinfo_domain_indices = True
341 # How to display URL addresses: 'footnote', 'no', or 'inline'.
342 #texinfo_show_urls = 'footnote'
344 # If true, do not generate a @detailmenu in the "Top" node's menu.
345 #texinfo_no_detailmenu = False