-
Hello,
I try to simulate EDC pyrolysis by using RMG. In the master branch of RMG-database, it has not yet included the Cl-Abstraction reaction family. Do the Chlorine branch work now?
This quest…
-
as the title suggests. Thermo Raw files with a µ character is the file name are not loading. When I remove the character the issues is resolved.
specific error below:
```
thread 'main' panicked at…
-
### Basic information
* My operating system and version: Linux Debian Sid
* My MZmine version: 3.9.0
### What happened
I have a Thermo raw file that I'm trying to open (not sure from which i…
-
**Is your feature request related to a problem? Please describe.**
When using ARC to run Arkane to obtain a rate constant, [ARC](https://github.com/ReactionMechanismGenerator/ARC/blob/master/arc/proc…
-
Hi again!
We tested DIANN 1.8 (by command line in linux) with the same file and observed different results depending on if we used .mzML or .raw files. For instance, this is the number of precurso…
-
----------------------------- Remove above -----------------------------
### Basic Infos
Adding the max6675 library to a sketch causes settings invalidated error
#### Hardware
WiFimana…
-
https://github.com/cpanse/MsBackendRawFileReader/blob/63d90b342cce3552b51ccca73b2adcad1eadc3b6/src/MsBackendRawFileReader.cs#L59
```{r}
#R
# BiocManager::install('cpanse/MsBackendRawFileReade…
-
I downloaded recently (less than a mont ago) RMG to get thermodynamics data.
Phenoxy radical is wrong.
I am not sure if your method uses Benson group additivity or Bozzelli corrections for radicals.
…
-
Each object should have some sort of metadata that explains the fields in each object. One example: "accession" in ModificationWithLocation is a Tuple, but it's not clear unless looking at the mzLib c…
-
(Jotting down some quick notes on this idea for now, not necessarily well thought out)
[inspect](https://docs.python.org/3/library/inspect.html#retrieving-source-code) is an amazing piece of the st…