diff --git a/propka/ligand_pka_values.py b/propka/ligand_pka_values.py index d64399f..fd70a48 100644 --- a/propka/ligand_pka_values.py +++ b/propka/ligand_pka_values.py @@ -163,20 +163,20 @@ class LigandPkaValues: [self.cxcalc, filename]+options.split(), stdout=subprocess.PIPE, stderr=subprocess.PIPE).communicate() if len(errors) > 0: - _LOGGER.info( + _LOGGER.error( '***********************************************************' '*********************************************') - _LOGGER.info( - '* Warning: Marvin execution failed: ' + _LOGGER.error( + '* Error: Marvin execution failed: ' ' *') - _LOGGER.info('* {0:<100s} *'.format(errors)) - _LOGGER.info( + _LOGGER.error('* {0:<100s} *'.format(errors)) + _LOGGER.error( '* ' ' *') - _LOGGER.info( + _LOGGER.error( '* Please edit the ligand mol2 file and re-run PropKa with ' 'the -l option: {0:>29s} *'.format(filename)) - _LOGGER.info( + _LOGGER.error( '***********************************************************' '*********************************************') sys.exit(-1)