Fixed bugs with progress file close

This commit is contained in:
Trung Nguyen
2024-07-24 23:50:18 -05:00
parent f254af2bab
commit eb5f45dfe7

View File

@ -160,13 +160,13 @@ def extract_data_to_yaml(inputFileName):
except yaml.YAMLError as exc:
if hasattr(exc, 'problem_mark'):
mark = exc.problem_mark
msg = f"Error parsing {inputFileName} at line {mark.line}, column {mark.column+1}."
msg = f" Error parsing {inputFileName} at line {mark.line}, column {mark.column+1}."
print(msg)
logger.info(msg)
logger.info(docs)
return thermo
else:
msg = f"Something went wrong while parsing {inputFileName}."
msg = f" Something went wrong while parsing {inputFileName}."
print(msg)
logger.info(msg)
logger.info(docs)
@ -375,6 +375,7 @@ def iterate(lmp_binary, input_folder, input_list, config, results, progress_file
msg = f"COMPLETED: {input} marked as completed in the progress file {progress_file}"
logger.info(msg)
print(msg)
progress.write(msg)
progress.close()
test_id = test_id + 1
continue
@ -451,6 +452,7 @@ def iterate(lmp_binary, input_folder, input_list, config, results, progress_file
progress.write(f"{input}: {{ folder: {input_folder}, status: skipped, unsupported log file format}}\n")
progress.close()
test_id = test_id + 1
continue
else:
logger.info(f" Cannot find a reference log file for {input_test}.")
# try to read in the thermo yaml output from the working directory
@ -460,7 +462,7 @@ def iterate(lmp_binary, input_folder, input_list, config, results, progress_file
thermo_ref = extract_thermo(thermo_ref_file)
num_runs_ref = len(thermo_ref)
else:
logger.info(f"SKIPPED: {thermo_ref_file} does not exist in the working directory.")
logger.info(f" SKIPPED: {thermo_ref_file} does not exist in the working directory.")
result.status = "skipped due to missing the log file"
results.append(result)
progress.write(f"{input}: {{ folder: {input_folder}, status: skipped, missing log file }}\n")
@ -476,7 +478,7 @@ def iterate(lmp_binary, input_folder, input_list, config, results, progress_file
# process error code from the run
if os.path.isfile("log.lammps") == False:
logger.info(f"ERROR: No log.lammps generated with {input_test} with return code {returncode}. Check the {log_file} for the run output.\n")
logger.info(f" ERROR: No log.lammps generated with {input_test} with return code {returncode}. Check the {log_file} for the run output.\n")
logger.info(f"\n{input_test}:")
logger.info(f"\n{error}")
progress.write(f"{input}: {{ folder: {input_folder}, status: error, no log.lammps }}\n")
@ -498,11 +500,11 @@ def iterate(lmp_binary, input_folder, input_list, config, results, progress_file
else:
result.status = "error, other reason"
logger.info(f"ERROR: Failed with {input_test} due to {result.status}.\n")
results.append(result)
progress.write(f"{input}: {{ folder: {input_folder}, status: {result.status} }}\n")
progress.close()
test_id = test_id + 1
continue
results.append(result)
progress.write(f"{input}: {{ folder: {input_folder}, status: {result.status} }}\n")
progress.close()
test_id = test_id + 1
continue
logger.info(f" Comparing thermo output from log.lammps against the reference log file {thermo_ref_file}")
if num_runs != num_runs_ref: