How to do parameter scanning
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Written by Jiankun Lyu, 2017/01/18
The hierarchy of the directory:
thin_spheres_parameter_scanning----- std_dockprep ------ dockfiles
| |
| |----- working
| |
| ------ other files generated balstermaster.py
|
------- script ------ dockprep_thin_spheres_in_batches.csh
|
|----- submit_dockprep_change_sphere_size.csh
|
|------ dockprep_thin_spheres.csh
|
|------ sph_lib.py
|
|------ pdb_lib.py
|
------- close_sph.py
1) Run blastermaster.py in std_dockprep. This will generate two directories: working and dockfiles