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Re: [Open Babel] Translation of crystallographic coordinates intoCartesian
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From: Noel O'B. <bao...@gm...> - 2011-04-12 15:03:33
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On 12 April 2011 13:49, Vincent Favre-Nicolin <vi...@us...> wrote: > Le 2011-04-12 à 09:27, nd...@su... a écrit : >> Hello! >> >> I am very grateful to you for your help! I couldn’t understand what the >> problem was for a long time. I looked at your files and now it seems >> everything is OK. > > OK, great - and thanks for your files, this was a good way to test thoroughly > the cif2cartesian conversion. > Now we should probably indicate somewhere in the OB doc the official reference > for the convention used. Where ? I would put it in the cifformat.cpp in the Description. This text is used is display by "babel -H", and is also used to create the online docs (and book!). - Noel |