Spectral preprocessing for 1D NMR (1H, 13C, 31P)
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Rnmr1D is a simple application (developed with R Shiny) that allows to perform the preprocessing of any 1D NMR spectrum (1H, 13C, 31P)




(C) LEGO


From
To

  • Spectrum
  • FID
  • Acquisition Parameters
  • Processing Parameters
  • Log 


                  

                

                

                  

                  

                    

                      
                      
                    

                  

                

                

                  

                    

                      

                    

                  

                

                

                  

                    

                      

                    

                  

                

                

                  

                    

                      

                    

                  

                

              

            

          

        

        

          

            

              

                
                
Saving as a JSON File

              

              

                

                  
                  
                

                
                
              

              

                
              

            

          

        

        

          

            

              

                
                
Saving as a PNG image

              

              

                

                  
                  
                

                
                
              

              

                
              

            

          

        

        

          

            

              

                
                
Saving as a CSV File

              

              

                

                  
                  
                

                

                  
                  
                

                

                  
                  
                

                

                  
                  
                

                

                  
                  

                    
                    
                  

                

                
                
              

              

                
              

            

          

        

      

      

        

          

            

            

              

                
                  
                
                
                
                  
Converter

                		
              

            

            

            

              Export the 1H-NMR spectrum within one file (
              nmrML
                format) that will embed all information, namely:
            

            
    
              
  • the raw spectrum in time domain (fid) along with the acquisition paramters and 
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  • the real part of the spectrum in frequency domain (1r) along with the preprocessing parameters.
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                  Download nmrML file
                
              

            

          

          

            

              

                Warning: Not yet supported for RS2D format
              

            

          

        

        

          

            

            
Please, upload a raw FID (fid) and its acquisition parameter file (acqus/procpar) within 'FID' tab.

          

        

        

          

            

            

          

        

      

      

        

        
Version 1.2.0 - (C) Daniel Jacob - INRAE UMR 1332, PMB, MetaboHUB, 2020