Clustering a large number of compounds. 2. Using the Connection Machine.
About 230,000 compounds in the National Cancer Institute Repository are available for screening under a new protocol. This paper is the second on an project to extract a representative sample of these compounds by clustering. The clustering program was implemented on the Connection Machine, a massively parallel computer with 16K processing elements. This implementation reduced a formidable task to a relatively routine run.
Whaley
R
R
Thinking Machines Corporation, Cambridge, Massachusetts 02142.
Hodes
L
L
D000465:Algorithms; D000970:Antineoplastic Agents / Q000737:chemistry*; D016000:Cluster Analysis; D003199:Computer Systems; D016208:Databases, Factual; D004353:Drug Evaluation, Preclinical; D015394:Molecular Structure
D000970:Antineoplastic Agents