Changeset 1705 in rotdif for bin/save_dock.py


Ignore:
Timestamp:
Aug 4, 2019, 3:26:06 PM (2 years ago)
Author:
yuexi
Message:

finish ellipsoid

File:
1 edited

Legend:

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Removed
  • bin/save_dock.py

    r1550 r1705  
    44def save_dock(dyna_flag, elm_flag, elmdock_flag):
    55    elm_pred = split_data(dyna_flag, elm_flag, elmdock_flag)[7]
    6     with open('ELMDOCK','w') as out_f:
     6    with open('elmdock_transformations.out','w') as out_f:
    77        for items in elm_pred:
    88            out_f.write(items+'\n')
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