自动化定点药物设计：在剑桥结构数据库中搜索用于自动化结构组装的分子片段中的键长。
Automated site-directed drug design: searches of the Cambridge Structural Database for bond lengths in molecular fragments to be used for automated structure assembly.
作者信息
Chau P L, Dean P M
机构信息
Department of Pharmacology, University of Cambridge, U.K.
出版信息
J Comput Aided Mol Des. 1992 Aug;6(4):397-406. doi: 10.1007/BF00125946.
PMID:1403030
Abstract
In this paper a database of small frequently occurring molecular fragments is used for the determination of fragment bond lengths from the Cambridge Structural Database. A large number of bond types are described that have not been reported previously.
摘要
在本文中，一个由频繁出现的小分子片段组成的数据库被用于从剑桥结构数据库中确定片段键长。文中描述了大量此前未被报道过的键型。
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