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Created by: tejakondury
Hello,
I am getting an index out of range error while running the code:
Traceback (most recent call last): File "pdb2lmp.py", line 301, in conv.write_data(args.outfiles + ".data") File "pdb2lmp.py", line 170, in write_data print("{0:8.3f} {1:8.3f} xlo xhi".format(-cell[0], cell[0]), file=data) IndexError: list index out of range
I am not sure if it is something that I am not doing correctly or a bug.
Thank you.
