Topomer shape similarity searching of familiar compound databases.

被引:0
|
作者
Cramer, RD [1 ]
Jilek, R [1 ]
机构
[1] Tripos Inc, St Louis, MO 63144 USA
关键词
D O I
暂无
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
53-CINF
引用
收藏
页码:U286 / U286
页数:1
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