Maxx Tessmer
Maxx Tessmer
Because the `conda` version of crest has not been updated since #139, I have recently compiled crest to overcome issues I experienced with the QCG functionality similar to #135. To...
## Is your feature request related to a problem? ## Currently, MDAnlysis is using both the `logging` module and the `warnings` module to warn users, even within the same file....
Biopython 1.83+ no longer has Bio.data.SCOPdata which is required by AF2. Rolling back to 1.81 fixes errors caused by the lack of this module.
Currently the conda-forge Python 3.12 Linux-64 distribution is broken. The package installs but none of the package functions work, e.g. running the example code: ```python import rtoml tomlstr = """\...