The Center for Computational Research at SUNY-Buffalo

8/15/99


Click here to start


Table of Contents

  1. The Center for Computational Research at SUNY-Buffalo
  2. Mission of CCR
  3. History of CCR
  4. Major Initial Focus of CCR: Computational Science
  5. Highlights
  6. Status Report: Equipment
  7. Status Report: Personnel
  8. Major Projects
  9. Diverse User Community
  10. Layout: 9 Norton Hall
  11. Management
  12. Status Report: EOT+
  13. PITAC Report
  14. X-Ray Crystallography
  15. The Phase Problem
  16. Shake-and-Bake
  17. Direct Methods
  18. Conventional Direct Methods
  19. Shake-and-Bake Method: Dual-Space Refinement
  20. Useful Relationships for Multiple Trial Phasing
  21. Phasing and Structure Size
  22. Structure of SnB
  23. SnB Parameters
  24. ToxII: SnB Histogram
  25. Tox II: Trace of SnB Solution
  26. Vancomycin
  27. Some Successful Protein Applications of Shake-and-Bake
  28. Se-Met Problems
  29. Some Successful SeMet Applications of Shake-and-Bake
  30. SnB 2.0: Timings (SGI R10000 Workstation)
  31. SnB Structure Diagram
  32. SnB v2.0 Interface
  33. SnB v2.0 Histogram
  34. SnB and Globus (ANL/USC)
  35. SnB Credits: R. Miller & C.M. Weeks
  36. Contact Information
Author: Russ Miller

Email: miller@cse.buffalo.edu

Home Page: http://www.cse.buffalo.edu/pub/WWW/faculty/miller/