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_**Please don't forget to add your information by 28 June! This will help the organisers to track your contributions throughout the Book Dash period.**_
## Summary
All Book Dash participants (3-…
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**Atom**: 1.14.0-beta3 x64
**Electron**: 1.3.13
**OS**: Mac OS X 10.12.3
**Thrown From**: [css-spy](https://github.com/stackroute/atom-css-spy) package 0.6.0
### Stack Trace
Failed to activat…
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Hi,
I am trying to integrate mzdeistope in my analysis pipeline for deconvoluting middle down spectra of antibodies. Now I've got it working but I was wondering if you can give me some recommendat…
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All the files ran through processing . Individual csv files created and individual MSMS mgf files created . Program is halted at this step and not running any further.
No pdf file created nor any dat…
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Thanks for adding exciting new features to SIRIUS 6! :-)
When testing the new version with mzML files, I noticed that the LC-MS chromatogram is not working anymore and I just get empty plots.
Is …
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To actually match detection of isotopic peaks in the data, a tool to generate an isotopic pattern library from a compound library should be implemented. The tool should consume a table with at minimum…
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### Description of the bug:
code:
```python
"""
Install the Google AI Python SDK
$ pip install google-generativeai
See the getting started guide for more information:
https://ai.google.dev…
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Test-h2co has a warning at the end
MODE FREQ(CM**-1) SYMMETRY RED. MASS IR INTENS. RAMAN ACT. DEPOLARIZ.
1 86.452 B2 3.821881 0.672525 2.946837 0.750000
2 …
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Hi,
There is a possible bug in the output format of the fragmentation tables of the Sirius output
(the parent MF, C42H42O19 is correct):
As fragments and heavier isotopic peaks are co-occurring i…
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## Issue Description
I've encountered an `IndexError: map::at: key not found` error while executing a Python script that integrates the OpenMS `SiriusAdapterAlgorithm` for processing mass spectrome…