Software

 Acquisition/Processing of NMR spectra

• VnmrJ Varian on VARIAN spectrometer
• XWINNMR et Topspin on BRUKER spectometer

 Processing and analyis of of NMR data

• NMRPipe/Draw Processing of 1D to 4D spectra, automated analysis of NMR spectra.
• NMRView et SparkyAssignment and Analysis of NMR Spectra.
• CSI Prediction of the proteins secondary structure using chemical shifts (HA, CA, CB).
• TALOS Prediction of Φ , Ψ protein backbone torsion angles using chemical shifts (HA, CA, CB, CO, N).

 Structure determination from NMR data
3D structures of biomolecules from distances, torsion angles and orientation constraints derived from NMR data.

• ARIA
• CYANA
• CNS

  Internal Dynamic

• Modelfree Determination of “ Lipari-Szabo modelfree” parameters using heteronuclear relaxation data.

 Docking

• HADDOCK Structure determination of protein-protein, protein-DNA and protein-ligand complexes using experimental data.

  Homology Modeling

• MODELLER

 3D Structure Visualization

• Pymol