Contents

• Recent additions
  • Version 1.3
  • Version 1.2
  • Version 1.1
  
  
• Introduction
• A word of caution
• Installation
  •  Using the stand-alone executables
  •  Building from source
  •  Parallel Qs
  •  Testing the executable
  
  
• A do-er's guide
  • One or more copies of the same model
  • One or more copies of several ( 2) models
  • In more detail : The data.hkl file
  • In more detail : The PDB files
  • In more detail : Running the program
  
  
• Interacting with the program
• Program output
• Identifying promising solutions
• What if automation fails ?
• Beyond automation
  • Constant temperature run
  • The slow-cooling mode
  • The Boltzmann annealing mode
  • The heating-bath mode
  
  
• The keywords
  • Command line options
  • Input file keywords
  
  
• Space group things
• Bugs