Bugfix/rdf bugfix#114

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stkroe wants to merge 47 commits intodevfrom

bugfix/rdf_bugfix

Commits on Aug 5, 2024

Commits on Aug 6, 2024

chore: Update setup.py, compiler directive for Python 3 compatibility is not needed
galjos
committed

Commits on Dec 11, 2024

add a function which adds not defined optional keys in the directory to avoid error messages after calling them
stkroe
committed
use this new not_defined_optional_keys function
stkroe
committed
add None in the if conditions to ensure that NoneType are not causing error messages
stkroe
committed
rewrite the not_defined_optional_keys function with __setitem__ method to ensure the set item is defined as tuple
stkroe
committed
add None in the function annotations
stkroe
committed
if restart file and moldescriptor are empty it is not working because of the selection. The topology would be empty if it is not defined.
stkroe
committed
target density was not defined for no_intra_molecular=False; now the rdf is running without error messages
stkroe
committed
Merge pull request #109 from MolarVerse/feature/len_in_atomsys
97gamjak
authored
Add .github/.pylint_cache on push event
github-actions[bot]
committed

Commits on Dec 12, 2024

add None as type for boolean assert_logging_with_exception
stkroe
committed

Commits on Dec 15, 2024

update GitHub Actions to use setup-python@v5
galjos
committed

Commits on Dec 30, 2024

Commits on Jan 7, 2025

Commits on Jan 8, 2025

Commits on Jan 13, 2025