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_config.yml
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_config.yml
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# Dependencies
markdown: kramdown
highlighter: rouge
# Permalinks
permalink: pretty
# Setup
title: MDAnalysis
name: MDAnalysis
tagline: molecular simulations data analysis
description: working with data in the molecular sciences
# long_description is not currently used by the theme
long_description: |
MDAnalysis is a Python library which enables the handling and
analysis of data from computer simulations of many-body
systems at the molecular scale, spanning use cases from
interactions of drugs with proteins to novel materials. It is
widely used in the scientific community and is written by
scientists for scientists.
url: https://www.mdanalysis.org
# leave baseurl empty,
# see https://github.com/MDAnalysis/MDAnalysis.github.io/issues/16#issuecomment-385572553
baseurl:
author:
name: The MDAnalysis Team
url: https://twitter.com/mdanalysis
email: [email protected]
images: /public/images
data_files: /public/data
js: /js
blog: /blog
# see https://help.github.com/articles/adding-jekyll-plugins-to-a-github-pages-site/
plugins:
- jekyll-paginate
- jekyll-mentions
- jekyll-sitemap
- jekyll-feed
# Blog pagination
paginate_path: "/blog/page:num/"
paginate: 3
# jekyll-feed
# - our previous feed was called atom.xml so we use it instead
# of the default feed.xml
feed:
path: atom.xml
# Custom vars
version: 2.0.0
# see also https://help.github.com/articles/repository-metadata-on-github-pages/
# for what GitHub makes available in site.github
github:
repo: https://github.com/MDAnalysis/mdanalysis
docs: https://docs.mdanalysis.org/dev
issues: https://github.com/MDAnalysis/mdanalysis/issues
wiki: https://github.com/MDAnalysis/mdanalysis/wiki
pypi:
package: https://pypi.org/project/MDAnalysis
tests: https://pypi.org/project/MDAnalysisTests
docs: https://docs.mdanalysis.org
mailinglists:
discussion:
name: GitHub Discussions
url: https://github.com/MDAnalysis/mdanalysis/discussions
developer:
name: GitHub Discussions (Development)
url: https://github.com/MDAnalysis/mdanalysis/discussions/categories/development
gsoc:
name: GitHub Discussions (GSoC)
url: https://github.com/MDAnalysis/mdanalysis/discussions/categories/gsoc-discussions
twitter:
name: mdanalysis
url: https://twitter.com/mdanalysis
discord:
name: MDAnalysis
url: https://discord.com/channels/807348386012987462/
invite: https://discord.gg/fXTSfDJyxE
docs:
mdanalysis:
name: Online Documentation
url: https://docs.mdanalysis.org
development:
name: Development Version Online Documentation
url: https://docs.mdanalysis.org/dev
userguide:
name: User Guide
url: https://userguide.mdanalysis.org
quickstart:
name: Quick Start Guide
url: https://userguide.mdanalysis.org/stable/examples/quickstart.html
# The algolia.read_only_api_key may be safely put into frontend code
# and this is not a security issue.
algolia:
index_name: mdanalysis
appId: Y8HJT3NO22
read_only_api_key: 68fa6789d0a275a311f68914e0c2366e
numfocus:
donate: https://numfocus.org/donate-to-mdanalysis
sponsored_project: https://numfocus.org/project/mdanalysis
donate_button: <a href="https://numfocus.org/donate-to-mdanalysis" target="_blank" style="background:#FF9200;padding:10px;margin:10px 0px;text-align:center;text-decoration:none;font-size:12pt;color:#000000;display:inline-block;border-radius:3px">Donate Now</a>