CURRENT INFORMATION

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CURRENT INFORMATION (IMPORTANT NEWS) - FEBRUARY 2021

  • below you will find the first completed version of the NMR TUTORIAL including now the variants of the 2D HSQC experiment and this experiment' application to other heteronuclei
  • there is a very last, slightly more demanding part that will be dedicated to the 2D ASAP-HSQC experiment. The addition of this sub-chapter is planned for the near future
  • unfortunately the files for the simulations with NMRSIM were not complete, for which I apologize. They have now been completed and include all simulations of the tutorial at hand. To download, proceed as described:
HOW TO DOWNLOAD THE (COMPLETED) NMRSIM-FILES
STEP 1:
  • Activate the following ILIAS-link and cause the download of the (compressed) file NMRSIM_FILES_TUTORIAL.zip to your local Downloads folder:
The download will start automatically.
In case the download does not start, configure your browser accordingly.
    STEP 2:
    • Open the download folder in a first window.
    • Open a second window and navigate to the directory /NMRSIM_SESSION (found in your personal user directory) with the folders config, ham, job, lists, pp, wave and wizard generated in the course of the TOPSPIN installation.
    • Note the entries in each of these folders delivered with the BRUKER TOPSPIN package, i.e. a set of corresponding configuration-, pulse program-. spin-system-, list- and wave-files for setting up a few demonstration experiments.
    • Note also the user subfolders, provided for storing your personal configuration-, pulse-program- etc. files.  
    STEP 3:
    • In the Download folder (first window) if not yet done automatically unzip the file NMRSIM_FILES_TUTORIAL.zip. Click on the unzipped directory which will uncover the folders config, ham, lists, pp and wave each of which contains a corresponding subfolder tutorial (see Fig. below).
    STEP 4:
    • Starting with the folder config (in the first window) click on it and – taking advantage of the drag-and-drop technique – move the tutorial subfolder into the config folder in the NMRSIM_SESSION directory (in the second window, i.e., on your computer):
    STEP 5:
    • According to the scheme above repeat this procedure one after the other with the residual tutorial subfolders for ham, lists, pp and wave.
    STEP 6:
    • Make sure that in your NMRSIM_SESSION directory any of the folders config, ham, lists, pp and wave has now been extended by a corresponding tutorial subfolder.
    • Inspect the various tutorial subfolders which should contain a series of corresponding configuration-, spin system (ham)-files, lists,  pulseprogram- and wave-files respectively, which will be used in the course of the tutorial. 
    • since the BRUKER website has been redesigned, some links had to be adapted
    • there will certainly still be errors and inadequacies in this first version of the tutorial. I apologize for this
         
          Peter Bigler


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