-
Feedback from Nikiforos:
http://users.uoa.gr/~nalygizakis/isotopes_issue_2ndtry/
and email Tuesday, 5 January 2016 1:23 PM
-
The default JavaScript offerings in Phoenix are pretty slim. We have a few third party plugins, some utility functions, and not much else. It would be nice to get our baseline JavaScript offerings up …
-
I'm not a mass spec person, but I've recently had to analyza a compound with formula that has multiple copper and sulphur atoms, and brainpy gives me pretty large deviations from the experimental spec…
-
As described in https://github.com/relaton/relaton-data-bipm/issues/17 .
This task supersedes #2 which implemented support to retrieve Metrologia bibliographic data from IOP but was unsatisfactory …
-
For reproduction feature 606 in M210115_001_Slot1-1_1_850.d
``` python3
data_handle = PyTimsDataHandle('/home/tim/Master/MassSpecDaten/M210115_001_Slot1-1_1_850.d/')
# precursors are listed in pr…
-
## Compiler version
tried 3.1.1 and 3.2.1
## Minimized code
I attach the build.sbt and single testA.sc source file.
test in sbt console with
:load testA.sc
val (res, p)=doTest
val (res, p)=do…
-
This thread will be used to **update the oxygen and hydrogen isotope ratios in the PMIP part of Emon**, aka _Roche variables_ because they were requested by Didier Roche (@dmr-dj) and the content of t…
-
Hi,
I searched through the issues and didn't find anyone else requesting information on this issue, I apologize if I missed one.
I'm using OpenMS (via pyOpenMS) to deisotope .mzXML files. We not…
-
We currently do not have a way to specify spectra from "higher isotopologue" precursors. For example, for a brominated compound we could be fragmenting the 81Br-isotopologue, i.e. 2 "isotopes" above […
-
Add functions to
- parse molecular formula to `list` and back
- create formula of an adduct based on neutral formula and adduct definition
- check if one formula is contained in another