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6 changes: 6 additions & 0 deletions rptools/rpthermo/__main__.py
Original file line number Diff line number Diff line change
Expand Up @@ -4,6 +4,10 @@
Logger,
getLogger
)
from os import (
makedirs as os_makedirs,
path as os_path
)
from typing import Dict
from colored import fg, bg, attr
from rptools.rpthermo import runThermo
Expand Down Expand Up @@ -53,6 +57,8 @@ def _cli():
# Print results
print_results(pathway, results, logger)
# Write pathway into file
# Create the output directory if not exists
os_makedirs(os_path.dirname(args.outfile), exist_ok=True)
pathway.to_rpSBML().write_to_file(args.outfile)
logger.info(
"{color}{typo}Written into file: {file}{rst}".format(
Expand Down
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