[spctools-discuss] MS1 quantification improvments?

2010-04-07 Thread Oded
Hi All, Are there any planned improvements or development of new tools for MS1 quantification. I use Xpress and it work pretty well for me but still require a bit of manual inspection. As for ASAPratio I find it to be usually off and to require a lot (too much) of manual inspection and correction

[spctools-discuss] Re: MS1 quantification improvments?

2010-04-07 Thread dctrud
Oded, What settings are you using for the ASAPRatio quantitation? We find that the m/z tolerance value (-r) is critical to getting good quantitation in complex samples. The default is +/- 0.5 m/z units, which is quite wide. If you're using Orbitrap / QTOF data then it definitely needs to be set

Re: [spctools-discuss] MS1 quantification improvments?

2010-04-07 Thread Jimmy Eng
Sadly the need for manual inspection isn't going to go away soon but things will get better with peak picking. I'll look into adding using median instead of mean as a user option. On Wed, Apr 7, 2010 at 12:44 AM, Oded oded.kleif...@gmail.com wrote: Hi All, Are there any planned improvements or

[spctools-discuss] Re: MS1 quantification improvments?

2010-04-07 Thread Oded
Thanks Jimmy - that would be great. Oded On Apr 7, 6:24 pm, Jimmy Eng jke...@gmail.com wrote: Sadly the need for manual inspection isn't going to go away soon but things will get better with peak picking.  I'll look into adding using median instead of mean as a user option. On Wed, Apr 7,