Alia Lescoulie
Alia Lescoulie
## Is your feature request related to a problem? ## To complete the overhaul of `nucinfo` we need to rebuild the rest of the functions in the analysis base style...
Fixes #3720 Changes made in this Pull Request: - Add a class for Major Pair and Minor Pair distance in the new overhauled nucleic acids module. PR Checklist ------------ -...
# mdpow.analysis.hbond The final analysis I would like to implement is quantifying hydrogen bonding between the solute and solvent. I figure this shouldn't be too difficult in MDAnalysis. This will...
# ensemble_wrapper decorator To simplify the process of extending AnalysisBase sub-classes to Ensembles I wrote a class decorator function. Example use: ```python class BaseTest(AnalysisBase): def __init__(self, system: mda.Universe): super(BaseTest, self).__init__(system.trajectory)...