NMRPipe
NMRPipe is an extensive software system for processing, analyzing, and exploiting multidimensional NMR spectroscopic data.
Usage
First, load the NMRPipe module:
module load nmrpipeInteractive
Once the module is loaded, you can run NMRPipe commands interactively by first running the command:
nmrpipeThat will provide you with a new prompt (e.g. [NMRPipe] username@bn-hpc-6:~>) at which you can run various NMRPipe commands (e.g. nmrPipe, nmrDraw, etc.).
Batch
To use NMRPipe non-interactively, load the module as described above. Then, precede your NMRPipe commands with nmrpipe-run, e.g.:
nmrpipe-run nmrPipe
nmrpipe-run var2pipeOr, you can pass it a script with a series of nmrPipe commands, e.g.:
nmrpipe-run source file.com