a series of programs for macromolecular NMR including AnalysisAssign, AnalysisScreen, AnalysisMetabolomics and AnalysisStructure, and with version 3, the addition CcpNmr ChemBuild.
Usage
To list all executables provided by CcpNmr Analysis, run:
$ sbgrid-list ccpnmr
Installation
Use the following command to install this title with the CLI client:$ sbgrid-cli install ccpnmr Available operating systems: Linux 64, OS X INTEL
Primary Citation*
W. F. Vranken, W. Boucher, T. J. Stevens, R. H. Fogh, A. Pajon, M. Llinas, E. L. Ulrich, J. L. Markley, J. Ionides, and E. D. Laue. 2005. The CCPN data model for NMR spectroscopy: development of a software pipeline. Proteins. 59(4): 687-696.
When Tim Stevens finished his PhD in biochemistry at the University of
Cambridge in 1999, he needed a job to tide him over for a few months. When
he discovered that his department had 9 months of grant funding for someone
to do Nuclear Magnetic Resonance Imaging (NMR) analysis, he applied.
Even though he'd never done NMR work before, he got the job, and so defined
the next decade of his career.
During that 9-month stint, Stevens solved one structure on his own and
assisted with another. "I'd done a lot of computing work and I knew my way
around a protein very well," he says, "so using the NMR software came
naturally to me."
The software Stevens was using had been written in the 1980s. "It was …
