SUNY-Buffalo’sCenter for Computational Research
1/22/00
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Table of Contents
SUNY-Buffalo's Center for Computational Research
History of CCR
PITAC Report
Mission of CCR
CCR Highlights I
CCR Highlights II
High-Performance Computing
Status Report: Supercomputers
Sun Cluster: Hardware
Sun Cluster: Software
Solaris Emulation
Benchmarks: PDGEMM
Benchmarks: Linpack Results
Sun Cluster: Application Software
Final Remarks on Sun Cluster
Status Report: Equipment
Status Report: Personnel
Management
Computational Science
Major Projects
Diverse User Community
X-Ray Crystallography
The Phase Problem
Shake-and-Bake
Conventional Direct Methods
Shake-and-Bake Method: Dual-Space Refinement
Useful Relationships for Multiple Trial Phasing
Phasing and Structure Size
ToxII: SnB Histogram
Tox II: Trace of SnB Solution
Vancomycin
Some Successful Protein Applications
Se-Met Problems
SnB SeMet Solutions
SnB and Globus (ANL/USC)
Status Report: EOT+
External Relationships
Graduate HPC Sequence
Graduate Certificate
Buffalo Museum of Science
High School Workshop
Students
Syllabus Week 1
Syllabus Week 2
Hardware and Tools
Projects and Presentations
Student Results
Presentations
Transfer of Ideas
Layout: 9 Norton Hall
Credits: Summer Workshop
SnB Credits (R. Miller & C. Weeks)
Sun Cluster Collaborators
Funding
Contact Information
Author:
Russ Miller
Email:
miller@ccr.buffalo.edu
Home Page:
http://www.ccr.buffalo.edu/