galaxycomputationalchemistry / galaxy-tools-compchem

:mega: Galaxy Tools for Computational Chemistry
Apache License 2.0
14 stars 16 forks source link

Add pdbfixer #154

Closed simonbray closed 2 years ago

simonbray commented 2 years ago

Fix #152.

simonbray commented 2 years ago

Updated the galaxy release so we can use the latest assertion fixes. GitHub won't run CI modified by a PR, but it is running in my fork and tests are passing: https://github.com/simonbray/galaxy-tools-compchem/actions/runs/2039704818

bgruening commented 2 years ago

Thanks. I guess it worked to persuade me :)