shirtsgroup / physical_validation

Physical validation of molecular simulations
https://physical-validation.readthedocs.io
MIT License
55 stars 19 forks source link

Introduce type hints, remove defaults for internal functions #151

Closed ptmerz closed 3 years ago

ptmerz commented 3 years ago

Introduce typing hints throughout the code Remove default values in the non-user facing functions (closes #116) Fix a bug using the default kB for equipartition in all cases