Open tasks for version 2021.1

[dominiquesydow]

Open tasks for the v2.0.0 release (after the merge of #74):

• Make sure Binder runs Include new talktorials to binder setup #130 (maybe in another PR after this one?)
• Website: Docs not synced with master? #105
• T018: Add a disclaimer that notebook is not ready yet: T018: Remove talktorial and add WIP note to README #142
• T018: Add talktorial: T018 Pipeline #125
• Add new tag v2.0.0
• Fix conda packaging; add package to conda-forge
• Website: Website: Some "previous" and "next" buttons are mixed up #143
• Website: T017: Website rendering is incorrect #141
• Website: Update talktorial collections: https://projects.volkamerlab.org/teachopencadd/talktorials.html Add missing nbsphinx thumbnails for nbsphinx gallery #161
• Cut the release
• Update the cf package

[dominiquesydow]

Conda packaging

TODOs

• Pip install autodocktools-prepare-py3k in respective notebooks not needed anymore
• Add opencadd to conda Add opencadd conda-forge/staged-recipes#16114
• Submit teachopencadd package to conda-forge

Questions

• What does this CI bit do?

  teachopencadd/.github/workflows/ci.yml

  Lines 109 to 146 in a27f702

  	condabuild:
  	name: Conda package
  	runs-on: ubuntu-latest
  	steps:
  	- uses: actions/checkout@v2
  	with:
  	fetch-depth: 0
  	- name: Fetch all tags
  	shell: bash
  	run: |
  	git fetch --tags --force
  	- uses: conda-incubator/setup-miniconda@v2
  	with:
  	python-version: 3.6
  	channel-priority: true
  	auto-activate-base: true
  	channels: conda-forge,defaults
  	- name: Additional info about the build
  	shell: bash
  	run: |
  	uname -a
  	df -h
  	ulimit -a
  	- name: Environment Information
  	shell: bash -l {0}
  	run: |
  	conda info --all
  	conda list
  	- name: Build package
  	shell: bash -l {0}
  	run: |
  	conda install conda-build anaconda
  	conda build devtools/conda-recipe

[jaimergp]

Submit teachopencadd package to conda-forge; use conda-recipe?

Yes, we might need to adapt some bits for cf, but most of the recipe is already there.

What does this CI bit do?

It builds the recipe locally, to ensure that our meta.yaml is still in good shape.

And yes, at least OpenCADD needs to be added to conda-forge. Autodocktools Prepare can be left outside and we just pip-install it in the relevant notebooks (it's a fork of an unmaintained project, makes little sense to package that sensibly).