Hello everyone：
I am trying to convert each spectrum in my pseudo-2D spectrum into ASCII files. My current approach is: using the "split2d" AU program to split the spectrum into multiple PROCNOs, then manually navigating to each PROCNO and running the "convbinasc" AU program to convert it into an ASCII file. Afterward, I process the data using a Python script. However, this process is somewhat cumbersome. I would like to know if it is possible to rewrite an AU program to automatically perform the step of reading PROCNO and executing "convbin2asc"?
Hi HongXin,
many years ago I worte such an AU. It coverts a 2rr file into a CSV. The first three rows show point nr., ppm and Hz and the first 3 colums show the same for f1. The matrix then shows the respective intensity for each coordinate. The AU program is attached. Regards Clemens
Clemens Anklin Thank you for your help, it has been really useful!
Additionally, I am curious if Bruker has an official AU program library to update new scripts?
Hongxin, each new version of software will have additional and updated AU programs. Make sure to run expinstall after each upgrade.
Hi Hongxin,
Personnally, I use nmrglue within python to take on the ser file, extract it, process it nmrPipe-style and use it with python afterwards for all fitting/integration purposes, within one script.
https://nmrglue.readthedocs.io/en/latest/examples/index.html
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