67个项目
aiida-wannier90-workflows
Advanced AiiDA workflows for Wannier90
disk_objectstore
An implementation of an efficient object store that writes directly on disk.
myst-nb
A Jupyter Notebook Sphinx reader built on top of the MyST markdown parser.
mdit-py-plugins
Collection of plugins for markdown-it-py
rst-fast-parse
A fast parser for reStructuredText
aiida-core
AiiDA is a workflow manager for computational science with a strong focus on provenance, performance and extensibility.
myst-docutils
An extended [CommonMark](https://spec.commonmark.org/) compliant parser,
myst-parser
An extended [CommonMark](https://spec.commonmark.org/) compliant parser,
sphinx_design
A sphinx extension for designing beautiful, view size responsive web components.
plumpy
A Python workflow library.
process_plot
Create plots of memory usage for a process.
sphinx-rust
Sphinx plugin for documentation of Rust projects.
aiida-lammps
AiiDA plugin for the LAMMPS code
jupyterlab-myst
Use MyST in JupyterLab
sphinx_tippy
Get rich tool tips in your sphinx documentation!
sphinx_sqlalchemy
Sphinx extension for documenting SQLAlchemy ORMs
kiwipy
Robust, high-volume, message based communication made easy.
sphinx_jinja2
A sphinx extension for peeking at internal references.
sphinx_peek
A sphinx extension for peeking at internal references.
sphinx_external_toc
A sphinx extension that allows the site-map to be defined in a single YAML file.
sphinx-jupyterbook-latex
Latex specific features for jupyter book
pytest_notebook
A pytest plugin for testing Jupyter Notebooks.
sphinx-autodoc2
Analyse a python project and create documentation for it.
jupyter-cache
A defined interface for working with a cache of jupyter notebooks.
sphinx_pytest
Helpful pytest fixtures for sphinx extensions.
markdown-it-pyrs
A Python interface for markdown-it.rs, using Rust for blazingly fast Markdown parsing ⚡️
pytest_param_files
Create pytest parametrize decorators from external files.
rst-to-myst
Convert RST to MyST-Markdown.
markdown-it-py
Python port of markdown-it. Markdown parsing, done right!
sphinx-design2
A sphinx extension for designing beautiful, view size responsive web components.
sphinx-autoapi2
Sphinx API documentation generator
fireflow
A simple async workflow engine for interfacing with FirecREST.
virtual_glob
Globbing of virtual file systems.
sphinx_pyscript
A sphinx extension for adding pyscript to a page
archive-path
A package to provide pathlib like access to zip & tar archives.
aiida-testing-dev
A pytest plugin for testing AiiDA plugins.
sphinx_timeline
A sphinx extension to create timelines.
aiida_eos
AiiDA plugin to calculate the equation of state of a material.
sphinx_subfigure
A sphinx extension to create sub-figures.
mdformat_deflist
An mdformat plugin for markdown-it-deflist.
aiida_conda_scheduler
AiiDA scheduler plugins that allow for `conda run`.
cjs_tutorial
Exemplar Python package.
aiida-quantumespresso-test
The official AiiDA plugin for Quantum ESPRESSO
aiida_upgrade
A tool to perform upgrades of AiiDA plugins to new aiida-core versions.
mdformat_footnote
An mdformat plugin for parsing/validating footnotes
mdformat_myst
Mdformat plugin for MyST compatibility.
furo_tb
Adding a topbar to the furo sphinx theme.
aiida_firecrest
AiiDA Transport/Scheduler plugins for interfacing with FirecREST.
pylint_aiida
A small plugin for aiida-core related linting.
sphinx-panels
A sphinx extension for creating panels in a grid layout.
jlab-aiidatree
A JupyterLab extension for exploring AiiDA databases.
jupytext-ebp
Jupyter notebooks as Markdown documents, Julia, Python or R scripts
aiida-crystal17
AiiDA plugin for running the CRYSTAL17 code
ipypublish
A workflow for creating and editing publication ready scientific reports, from one or more Jupyter Notebooks
activate-aiida
a package to activate an aiida environment, from a yaml config file
ase-notebook
Highly configurable 2D (SVG) & 3D (threejs) visualisations for ASE/Pymatgen structures, within the Jupyter Notebook
mistletoe-ebp
A fast, extensible Markdown parser in pure Python.
aiida-gulp
AiiDA plugin for running the GULP MD code
aiida-crystal
AiiDA plugin for CRYSTAL17
aiida-icl
AiiDA plugin interfacing with the Imperial College London cx1 HPC
jsonextended
Extending the python json package functionality
ejplugins
parser plugins for jsonextended
atomic-hpc
A package for running multiple executable scripts on both local and remote hosts, configured using a YAML file
bib2glossary
A package to convert between a latex bib file and a tex file containing glossaries entries
ipyatom
a package primarily for interfacing ase/pymatgen with ipyvolume/matplotlib
pandas3js
a pandas dataframe interface for traitlets and pythreejs
pygauss
Python API for analysis and documentation of molecular chemical computations