Révision 47 database/import_gaussian_calc

import_gaussian_calc (revision 47)
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    parser.add_argument("-e", "--exclude_dir",help="Directory to be excluded in the scanning")
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    parser.add_argument("-d", help="Name of the database file to store the scanned calculations")
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    parser.add_argument("-n", help="Number of processers")
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    parser.add_argument("-u", help="The user who did the calculations")
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    parser.add_argument("-j", help="Project name")
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    args = parser.parse_args()
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    if args.path is None:
......
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        nproc = 8
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    else:
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        nproc = int(args.n)
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    if args.u is None:
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        user = os.environ['USER']
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    else:
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        user = args.u
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    if args.j is None:
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        project = 'gaussian'
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    else:
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        project = int(args.j)
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    import_gaussian_calculations(path, db, use_input=use_input, include_dir=include_dir, exclude_dir=exclude_dir, project=project, nproc=nproc)


  		





  
  159
  
    
    import_gaussian_calculations(path, db, use_input=use_input, include_dir=include_dir, exclude_dir=exclude_dir, project=project, nproc=nproc,user=user)


  		












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