From: Noel O'B. <no...@ca...> - 2006-05-16 17:13:44
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It's taking me a while to get an a/c on the Jaguar machine but I would like to get a release out as soon as possible. I'd like to add support for atomcoords to all of the main parsers, and get a release out next week or the week after with good support for ADF, GAMESS and Gaussian. Once we get Jaguar in shape we can get another release out. I've posted on the ADF forum regarding the SCF values, and if we get an answer I'll be able to fix that once and for all (I see it causes a unittest failure too). You or I should do a global rename of nindep to nmo, if you agree. Oh yes, we/I need to get aonames parsed for GAMESS and Gaussian (I think that's low-hanging fruit, as they say). Is there anything else you would like before a release? We can call it cclib-0.5 or something, what do you think? Regards, Noel |