INNER CODE UNIT · Python

run_pdb2pqr

Electrostatics/pdb2pqr · pdb2pqr/main.py:982

def run_pdb2pqr(args: Sequence[str | PathLike]):
    """Run PDB2PQR with a list of arguments.

    Logger is not set up so that it can be called multiple times.

    :param args:  list of command-line arguments
    :type args:  list
    :return:  results of PDB2PQR run
    :rtype:  tuple
    """
    args_strlist = [str(arg) for arg in args]
    parser = build_main_parser()
    args_parsed = parser.parse_args(args_strlist)
    return main_driver(args_parsed)


def dx_to_cube():
    """Convert DX file format to Cube file format.

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