The MultiCASE Program II. Baseline activity identification algorithm (BAIA)

被引:31
作者
Klopman, G [1 ]
机构
[1] Case Western Reserve Univ, Dept Chem, Cleveland, OH 44106 USA
来源
JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES | 1998年 / 38卷 / 01期
关键词
D O I
10.1021/ci9700790
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
A new algorithm is presented that allows one to uncover underlying relations between the biological activity of a diverse set of molecules and a global parameter such as the partition coefficient, solubility, and/or the redox properties.
引用
收藏
页码:78 / 81
页数:4
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