From: Egon W. <ego...@gm...> - 2007-12-29 15:04:50
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On Dec 29, 2007 3:45 PM, Rajarshi Guha <rg...@in...> wrote: > On Dec 29, 2007, at 8:30 AM, Egon Willighagen wrote: > Hmm, I see that they are now memory efficient, but it still does not > appear to solve the problem of what length will be returned before > parameters. Each descriptor must have default parameters (which I why I am not so happy about 'null' parameters...) > Wouldn't it be better to query the length of the names descriptor (or > Bal*DescriptorResult) as obtained from the DescriptorValue? It would > avoid adding an extra class DescriptorValue is only available after calculating... we need a way to pass the length before calculation... and we need to know what result type we can expect... right now, it's just arrays, and single values, but it may return a matrix too... Egon -- ---- http://chem-bla-ics.blogspot.com/ |