Mercurial > repos > bgruening > openbabel_subsearch
diff remove_protonation_state.py @ 12:7cd8039c6c46 draft
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/openbabel commit 944ea4bb8a9cd4244152a4a4fecd0485fabc2ad0"
author | bgruening |
---|---|
date | Tue, 28 Jul 2020 11:56:25 +0000 |
parents | 3286789c2e4c |
children | fddf49cce800 |
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--- a/remove_protonation_state.py Thu Apr 09 13:50:32 2020 +0000 +++ b/remove_protonation_state.py Tue Jul 28 11:56:25 2020 +0000 @@ -6,9 +6,9 @@ """ import sys, os import argparse -import openbabel + +from openbabel import openbabel, pybel openbabel.obErrorLog.StopLogging() -import pybel def parse_command_line(): parser = argparse.ArgumentParser()