University at Buffalo
The State University of New York
CCR
Center for
Computational Research
Antibiotics
& Supercomputers
Result: New, better drugs in shorter time
nVancomycin solved with SnB (UB/HWI)
qSnB:
“Top Algorithms of the Century”
q“Antibiotic of Last Resort”
qOriginal molecular structure required 5 months
q(Re)solved in a single day on CCR’s supercomputers
qCurrent Efforts: Grid, Collaboratory, Intelligent
Learning