run
run(density_map, structure, result_dir, options)
Run powerfit on the given density map and structure, saving results to result_dir.
If resuls_dir / solutions.out already exists, it skips the run.
Parameters:
Name | Type | Description | Default |
---|---|---|---|
density_map
|
BinaryIO
|
The density map file to fit the structure into. |
required |
structure
|
Path
|
The path to the prepared PDB structure file. |
required |
result_dir
|
Path
|
The directory where results will be saved. |
required |
options
|
PowerfitOptions
|
Options for running powerfit, including resolution, angle, etc. |
required |