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Re: [modeller_usage] Trouble with SOAP Score



On 12/4/20 9:14 AM, Brenda de Souza Ferrari wrote:
I downloaded  the SOAP-Protein potential file from the SOAP website and placed at C:\ProgramFiles\Modeller9.25\lib\x86_64-w64, uncommented the SOAP-related lines in model-single.py but when i try to run the script i receive an error:
...
        346 in H5FD_sec2_open(): unable to open file: name = 'C:\Program
        Files\Modeller9.25/modlib\/soap_protein_od.hdf5', errno = 2,
        error message = 'No such file or directory', flags = 0, o_flags = 0

You put the HDF5 file in the wrong directory.

	Ben Webb, Modeller Caretaker
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