Skip to content

Update pl_upgrades to use numpy 2 and update other dependencies#533

Merged
jnwei merged 125 commits into
aqlaboratory:pl_upgradesfrom
jnwei:pl_upgrades
Apr 25, 2025
Merged

Update pl_upgrades to use numpy 2 and update other dependencies#533
jnwei merged 125 commits into
aqlaboratory:pl_upgradesfrom
jnwei:pl_upgrades

Conversation

@jnwei
Copy link
Copy Markdown
Collaborator

@jnwei jnwei commented Apr 25, 2025

Noteable updates include:

  • Support for numpy v2
  • Support for openmm>=8
  • Merge changes from main branch pl_upgrades (mostly documentation changes)
  • Some minor updates to installation and inference documentation

dingquanyu and others added 30 commits February 15, 2024 18:04
This makes it more straightforward to create an alignment database directly from the flattened RODA downloads
This adds support for duplicate chain expansion for the alignment dir format. This script can be run on the flattened non-redundant RODA alignments to add explicit directories for all of the duplicate chains in the duplicate_chains file, symlinked to their representative chain alignment directory.
The commit used so far now fails with Colab's numpy.
(Commit from current main does not work either.)
The previous data_dir_to_fasta.py script is very slow and requires fully reparsing mmCIF files. This new script is much faster and uses the sequence information from the alignment data instead. Note that this will not include chains for which alignments could not be generated, but we can't use those during training anyways.
etowahadams and others added 28 commits November 13, 2024 11:40
…all-docs

docs: Add env var instructions to install guide
…ahadams/install-docs

Revert "docs: Add env var instructions to install guide  "
merge changes from upstream pl_upgrades
small fix to spacing
small fix to spacing
@jnwei jnwei merged commit 1ffd197 into aqlaboratory:pl_upgrades Apr 25, 2025
1 check passed
jaewshin pushed a commit to jaewshin/openfold that referenced this pull request Mar 7, 2026
Update pl_upgrades to use numpy 2 and update other dependencies
Sign up for free to join this conversation on GitHub. Already have an account? Sign in to comment

Labels

None yet

Projects

None yet

Development

Successfully merging this pull request may close these issues.

10 participants