Tutorials: Difference between revisions
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== File formats == | == File formats == | ||
<div style="column-count: | <div style="column-count:2;-moz-column-count:2;-webkit-column-count:2"> | ||
* [[Residue library file]] | * [[Residue library file]] | ||
* [[Sequence file]] | * [[Sequence file]] |
Revision as of 13:05, 29 January 2009
Example calculations
- Basic structure calculation starting from given restraints
- Structure calculation using manually assigned NOESY peak lists
- Structure calculation with automated NOESY assignment
- Structure calculations using residual dipolar coupling restraints
- Structure calculations using pseudocontact shift restraints
- Various additional tasks
File formats
- Residue library file
- Sequence file
- Distance restraint file
- Torsion angle restraint file
- Residual dipolar coupling restraint file
- Pseudocontact shift restraint file
- DG Cartesian coordinate file
- PDB coordinate file
- Torsion angle file
- Chemical shift list file
- XEASY peak list file
- NMRView peak list file