From: Karol L. <kar...@gm...> - 2015-09-11 14:58:32
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Very nice. I should also have an increasing amount of time for cclib in the coming weeks/months. On Thu, Sep 10, 2015 at 12:45 PM, Eric Berquist <er...@pi...> wrote: > Yes, I was hoping to update a lot of the written documentation, since > information about the newest parsers is a bit sparse. > > I've also been working on a set of IPython/Jupyter notebooks for the > undergrads I mentor that show how to use Python for quantum chemistry. The > start of an incomplete one on cclib is here: > > > https://github.com/berquist/ipython_notebooks_for_qc/blob/master/notebooks/Using%20cclib.ipynb > > On Thu, Sep 10, 2015 at 2:23 AM, Karol Langner <kar...@gm...> > wrote: > >> That is great! Perhaps we could update the tutorial on cclib.github.io >> to reflect that. >> >> On Wed, Sep 9, 2015 at 12:21 PM, Eric Berquist <er...@pi...> wrote: >> >>> On a related note, a few months ago I made cclib packages for Arch >>> Linux, since that's what I develop on: >>> >>> https://aur.archlinux.org/packages/?O=0&K=cclib >>> >>> On Tue, Sep 8, 2015 at 10:34 PM, Karol Langner <kar...@gm...> >>> wrote: >>> >>>> FYI 1.3.1 is now in Debian testing. >>>> >>>> ---------- Forwarded message ---------- >>>> From: Debian testing watch <no...@re...> >>>> Date: Fri, Sep 4, 2015 at 9:39 AM >>>> Subject: [Debichem-devel] cclib 1.3.1-1 MIGRATED to testing >>>> To: cc...@pa... >>>> >>>> >>>> FYI: The status of the cclib source package >>>> in Debian's testing distribution has changed. >>>> >>>> Previous version: 1.1-1 >>>> Current version: 1.3.1-1 >>>> >>>> -- >>>> This email is automatically generated once a day. As the installation >>>> of >>>> new packages into testing happens multiple times a day you will receive >>>> later changes on the next day. >>>> See https://release.debian.org/testing-watch/ for more information. >>>> >>>> _______________________________________________ >>>> Debichem-devel mailing list >>>> Deb...@li... >>>> http://lists.alioth.debian.org/cgi-bin/mailman/listinfo/debichem-devel >>>> >>>> >>>> >>>> ------------------------------------------------------------------------------ >>>> Monitor Your Dynamic Infrastructure at Any Scale With Datadog! >>>> Get real-time metrics from all of your servers, apps and tools >>>> in one place. >>>> SourceForge users - Click here to start your Free Trial of Datadog now! >>>> http://pubads.g.doubleclick.net/gampad/clk?id=241902991&iu=/4140 >>>> _______________________________________________ >>>> cclib-devel mailing list >>>> ccl...@li... >>>> https://lists.sourceforge.net/lists/listinfo/cclib-devel >>>> >>>> >>> >>> >>> ------------------------------------------------------------------------------ >>> Monitor Your Dynamic Infrastructure at Any Scale With Datadog! >>> Get real-time metrics from all of your servers, apps and tools >>> in one place. >>> SourceForge users - Click here to start your Free Trial of Datadog now! >>> http://pubads.g.doubleclick.net/gampad/clk?id=241902991&iu=/4140 >>> _______________________________________________ >>> cclib-devel mailing list >>> ccl...@li... >>> https://lists.sourceforge.net/lists/listinfo/cclib-devel >>> >>> >> > |