Closed stuartmac closed 7 years ago
from prointvar.dssp import DSSPrunner, DSSPreader input_struct = os.path.join(cfg.db_root, cfg.db_pdbx, '2pah.cif') output_dssp = os.path.join(cfg.db_root, cfg.db_dssp, '2pah.dssp') DSSPrunner(inputfile=input_structure, outputfile=output_dssp).write() df2 = DSSPreader(inputfile=output_dssp).read() # pandas DataFrame df2.head()
input_structure should be input_struct or the other way round...
input_structure
input_struct
Fixed https://github.com/bartongroup/FM_ProIntVar-Core/commit/ff35b1bbb1eab580acfb059409ae324b0462e6fa
input_structure
should beinput_struct
or the other way round...