From: Steffen N. <sne...@ip...> - 2010-01-13 13:52:40
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On Wed, 2010-01-13 at 13:12 +0100, Andreas Bertsch wrote: > I agree with Fredrik. The costs for the simplifications are too high. Yes, it's not for free :-( > Separating the targets and transitions seems reasonable to me, because > these are to very different things. Are they ? Analytically yes, because you program the MS machine in different ways, either (auto-)MS/MS or SRM. Conceptionally no, because if I have observed a pair of precursor/product ions and use that as a hint that the predicted interpretation is true, no matter whether you have measured that by SRM or a normal QQQ or QqTOF tandemMS experiment. Granted, only the <precursor> information will not be enough for a usable <interpretation>. On the other hand, to analyse a normal tandemMS experiment, you could even specify multiple <product>s for one precursor, which you require for a sufficiently confident peptideRef="ABC". (If I saw that correctly from the traML schema, the current approach is to create multiple <transition> to hold multiple <product>s) Again, I think I can be persuaded/convinced if there is a definition of use case(s) for traML, and my ideas fall well outside of it. Has anyone start that already ? > The subelements are reused for both of the lists, which is I think a > good trade-off between a light-weight schema and straight-forward > structure. And that even allows the mapping file to distinguish between a retention time inside a <transition> vs. a retention time in a <target>. But that should not be the main point. Yours, Steffen -- IPB Halle AG Massenspektrometrie & Bioinformatik Dr. Steffen Neumann http://www.IPB-Halle.DE Weinberg 3 http://msbi.bic-gh.de 06120 Halle Tel. +49 (0) 345 5582 - 1470 +49 (0) 345 5582 - 0 sneumann(at)IPB-Halle.DE Fax. +49 (0) 345 5582 - 1409 |