Add python 3.9 to CI? - Githubissues

jensengroup / propka

PROPKA predicts the pKa values of ionizable groups in proteins and protein-ligand complexes based in the 3D structure.

http://propka.org

GNU Lesser General Public License v2.1

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Closed IAlibay closed 3 years ago

IAlibay commented 3 years ago

As far as I can tell all the dependencies for propka are now python 3.9 compatible. I checked it out locally and all the tests run fine.

sobolevnrm commented 3 years ago

Looks great. I added @speleo3 and @orbeckst for a quick review as well. We try to get multiple eyes on PR, even when it's a simple one like this.