Mercurial > repos > bgruening > openbabel_remions

directory / @ 13:3153b6f3087c draft

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dir. test-data/ drwxr-xr-x
file change_title_to_metadata_value.py 1483 -rwxr-xr-x
file cheminfolib.py 9597 -rw-r--r--
file distance_finder.py 3342 -rw-r--r--
file macros.xml 1624 -rw-r--r--
file multi_obgrep.py 3544 -rw-r--r--
file ob_addh.py 1319 -rw-r--r--
file ob_filter.py 5159 -rwxr-xr-x
file ob_genProp.py 2044 -rw-r--r--
file ob_remIons.py 1357 -rw-r--r--
file ob_remIons.xml 1577 -rw-r--r--
file ob_spectrophore_search.py 3367 -rw-r--r--
file remove_protonation_state.py 1199 -rw-r--r--
file subsearch.py 3841 -rw-r--r--