CLUSTERING A LARGE NUMBER OF COMPOUNDS .2. USING THE CONNECTION MACHINE

被引：12

作者：

WHALEY, R

HODES, L

机构：

[1] NCI,BETHESDA,MD 20892

[2] THINKING MACHINES CORP,CAMBRIDGE,MA 02142

来源：

JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES | 1991年 / 31卷 / 02期

关键词：

D O I：

10.1021/ci00002a022

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

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.

引用

页码：345 / 347

页数：3