Class CreateRotamers


public class CreateRotamers extends AlgorithmsCommand
The CreateRotamers script creates a set of conformation dependent rotamers.
Usage:
ffxc test.CreateRotamers [options] <filename>
  • Field Details

  • Constructor Details

    • CreateRotamers

      public CreateRotamers()
      CreateRotamers Constructor.
    • CreateRotamers

      public CreateRotamers(FFXBinding binding)
      CreateRotamers Constructor.
      Parameters:
      binding - The Binding to use.
    • CreateRotamers

      public CreateRotamers(String[] args)
      CreateRotamers constructor that sets the command line arguments.
      Parameters:
      args - Command line arguments.
  • Method Details