corm_data/prepare/process.py
Function process_xyz_md17
has a Cognitive Complexity of 16 (exceeds 5 allowed). Consider refactoring. Open
Open
def process_xyz_md17(datafile):
"""
Read xyz file and return a molecular dict with number of atoms, energy, forces, coordinates and atom-type for the MD-17 dataset.
Parameters
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Cognitive Complexity
Cognitive Complexity is a measure of how difficult a unit of code is to intuitively understand. Unlike Cyclomatic Complexity, which determines how difficult your code will be to test, Cognitive Complexity tells you how difficult your code will be to read and comprehend.
A method's cognitive complexity is based on a few simple rules:
- Code is not considered more complex when it uses shorthand that the language provides for collapsing multiple statements into one
- Code is considered more complex for each "break in the linear flow of the code"
- Code is considered more complex when "flow breaking structures are nested"
Further reading
Function process_xyz_files
has a Cognitive Complexity of 9 (exceeds 5 allowed). Consider refactoring. Open
Open
def process_xyz_files(data, process_file_fn, file_ext=None, file_idx_list=None, stack=True):
"""
Take a set of datafiles and apply a predefined data processing script to each
one. Data can be stored in a directory, tarfile, or zipfile. An optional
file extension can be added.
- Read upRead up
Cognitive Complexity
Cognitive Complexity is a measure of how difficult a unit of code is to intuitively understand. Unlike Cyclomatic Complexity, which determines how difficult your code will be to test, Cognitive Complexity tells you how difficult your code will be to read and comprehend.
A method's cognitive complexity is based on a few simple rules:
- Code is not considered more complex when it uses shorthand that the language provides for collapsing multiple statements into one
- Code is considered more complex for each "break in the linear flow of the code"
- Code is considered more complex when "flow breaking structures are nested"
Further reading
Function process_xyz_files
has 5 arguments (exceeds 4 allowed). Consider refactoring. Open
Open
def process_xyz_files(data, process_file_fn, file_ext=None, file_idx_list=None, stack=True):