Automated Dihedral Analysis - #217

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orbeckst merged 182 commits into

automated-dihedral-analysis

Feb 12, 2023

cadeduckworth commented Oct 20, 2022 •

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Adding automation functionality for dihedral analysis
Automation function for dihedral analysis includes retrieval of dihedral atom groups and visual representation of data via seaborn-catplot violin plots
close add appropriate error, exception, logging methods for these patterns, throughout #236

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