From: Karol L. <kar...@gm...> - 2016-03-01 20:49:14
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Hi Bert, Cross-posting to cclib-dev. That is something we are definitely eager to build into cclib. Karol On Tue, Mar 1, 2016 at 10:21 AM, Wibe de Jong <wad...@lb...> wrote: > Just look dat cclib. Marcus and I worked on parsing everything in an > NWChem output via a Python script, and putting the data in a Chemical JSON > format for NWChem. I probably should contribute some of this here. Also > have a Fortran90 Chemical JSON writer that allows QC codes to write out > directly to Chemical JSON. Looking to build a C++ analogue as both will > cover most codes. > > Bert > > On Tue, Mar 1, 2016 at 7:56 AM, Geoffrey Hutchison <ge...@pi...> > wrote: > >> >> OpenChemistry has been accepted into the Google Summer of Code for 2016 - >> including Open Babel, Avogadro, cclib and 3DMol.js >> https://summerofcode.withgoogle.com/organizations/6290185763422208/ >> http://wiki.openchemistry.org/GSoC_Ideas_2016 >> >> If you are a student and interested in doing open chemistry software >> development this summer (or know of someone who is), we're definitely >> interested in good proposal ideas. >> >> Looking forward to a summer of great science! >> >> Cheers, >> -Geoff >> >> ------------------------------------------------------------------------------ >> Site24x7 APM Insight: Get Deep Visibility into Application Performance >> APM + Mobile APM + RUM: Monitor 3 App instances at just $35/Month >> Monitor end-to-end web transactions and take corrective actions now >> Troubleshoot faster and improve end-user experience. Signup Now! >> http://pubads.g.doubleclick.net/gampad/clk?id=272487151&iu=/4140 >> _______________________________________________ >> Blueobelisk-discuss mailing list >> Blu...@li... >> https://lists.sourceforge.net/lists/listinfo/blueobelisk-discuss >> > > > > ------------------------------------------------------------------------------ > Site24x7 APM Insight: Get Deep Visibility into Application Performance > APM + Mobile APM + RUM: Monitor 3 App instances at just $35/Month > Monitor end-to-end web transactions and take corrective actions now > Troubleshoot faster and improve end-user experience. Signup Now! > http://pubads.g.doubleclick.net/gampad/clk?id=272487151&iu=/4140 > _______________________________________________ > Blueobelisk-discuss mailing list > Blu...@li... > https://lists.sourceforge.net/lists/listinfo/blueobelisk-discuss > > |