Phase refinement and extension by means of non-crystallographic symmetry averaging using parallel computers.

نویسندگان

  • M A Cornea-Hasegan
  • Z Zhang
  • R E Lynch
  • D C Marinescu
  • A Hadfield
  • J K Muckelbauer
  • S Munshi
  • L Tong
  • M G Rossmann
چکیده

Electron-density averaging, fast Fourier synthesis and fast Fourier analysis programs have been adapted for parallel-computing systems. These have been linked to perform iterative phase improvement and extension utilizing non-crystallographic symmetry and solvent flattening. Various strategies for parallel algorithms have been tested on a variety of computers as a function of the number of computer nodes. Some experimental timing results are discussed.

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عنوان ژورنال:
  • Acta crystallographica. Section D, Biological crystallography

دوره 51 Pt 5  شماره 

صفحات  -

تاریخ انتشار 1995