Mercurial > repos > bgruening > openbabel_obgrep
diff multi_obgrep.py @ 11:78640d0127ce draft
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/openbabel commit 944ea4bb8a9cd4244152a4a4fecd0485fabc2ad0"
author | bgruening |
---|---|
date | Tue, 28 Jul 2020 08:36:19 -0400 |
parents | b0311f002a5f |
children | 2912ebf12ef2 |
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--- a/multi_obgrep.py Thu Apr 09 10:05:05 2020 -0400 +++ b/multi_obgrep.py Tue Jul 28 08:36:19 2020 -0400 @@ -6,15 +6,14 @@ """ import sys, os import argparse -import openbabel -openbabel.obErrorLog.StopLogging() -import pybel import multiprocessing import tempfile import subprocess import shutil import shlex +from openbabel import openbabel, pybel +openbabel.obErrorLog.StopLogging() def parse_command_line(): parser = argparse.ArgumentParser() parser.add_argument('-i', '--infile', required=True, help='Molecule file.')