nmraspecds.de

Reproducible analysis of NMR data based on the ASpecD framework

User Tools

Site Tools


index

Differences

This shows you the differences between two versions of the page.

Link to this comparison view

Both sides previous revision Previous revision
Next revision
Previous revision
index [2025/03/11 01:08]
192.168.122.1 old revision restored (2025/03/05 17:40)
index [2025/04/09 19:11] (current)
till
Line 1: Line 1:
-====== nmraspecds ======+====== NMRAspecds ======
  
-//Reproducible analysis of NMR data//+Reproducible analysis of NMR data based on the [[https://www.aspecd.de/|ASpecD framework]]
  
 +[[https://doi.org/10.5281/zenodo.13293054|{{zenodo.13293054.png}}]]
  
-nmraspecds is a Python package based on the [[https://www.aspecd.de/|ASpecD framework]] for handling data obtained using nuclear magnetic resonance (NMR) spectroscopy focussing on **reproducibility**. In short: Each and every processing step applied to your data will be recorded and can be traced back. Additionally, for each representation of your data (//e.g.//, figures, tables) you can easily follow how the data shown have been processed and where they originate from.+NMRAspecds is a Python package based on the [[https://www.aspecd.de/|ASpecD framework]] for handling data obtained using nuclear magnetic resonance (NMR) spectroscopy focussing on **reproducibility**. In short: Each and every processing step applied to your data will be recorded and can be traced back. Additionally, for each representation of your data (//e.g.//, figures, tables) you can easily follow how the data shown have been processed and where they originate from.
  
 What is even better: Actual data processing and analysis **no longer requires programming skills**, but is as simple as writing a text file summarising all the steps you want to have been performed on your dataset(s) in an organised way. Curious? Have a look at [[https://docs.nmraspecds.de/|its documentation]]. What is even better: Actual data processing and analysis **no longer requires programming skills**, but is as simple as writing a text file summarising all the steps you want to have been performed on your dataset(s) in an organised way. Curious? Have a look at [[https://docs.nmraspecds.de/|its documentation]].
Line 37: Line 38:
 ===== License and citation ===== ===== License and citation =====
  
-cwepr is **free and open source** licensed under a [[.:license|BSD 2-clause license]].+NMRaspecds is **free and open source** licensed under a [[.:license|BSD 2-clause license]]. However, if you use cwepr for your own research, please cite both, the article describing it and the software itself: 
 + 
 +  * Mirjam Schröder, NMRAspecds (2025). [[https://doi.org/10.5281/zenodo.13293054|doi:10.5281/zenodo.13293054]] 
 + 
 + 
 + 
 + 
 +===== News ===== 
 + 
 +Note: The most up-to-date information can be found in the [[https://docs.nmraspecds.de/changelog.html|changelog]] included in the [[https://docs.nmraspecds.de/|package documentation]]. 
 + 
 +  * 2025-01-12: **NMRAspecds v0.2.0 released** 
 +    * [[https://github.com/majrim-spc/nmraspecds/releases/tag/v0.2.0|Changelog (GitHub)]] 
 + 
 +  * 2024-08-11: **NMRAspecds v0.1.0 released** 
 +    * [[https://github.com/majrim-spc/nmraspecds/releases/tag/v0.1.0|Changelog (GitHub)]]
  
index.1741651717.txt.gz · Last modified: 2025/03/11 01:08 by 192.168.122.1